1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one

C178H350N30O16 — CID 157207913

IUPAC1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one
SMILESCC(C)C(=O)N1CCC(CCN)CC1.CC(C)C(=O)N1CCC(CN(C)C)CC1.CC(C)C(=O)N1CCC(CN)CC1.CC(C)C(=O)N1CCC(N)CC1.CC(C)C(=O)N1CCCC(CN(C)C)C1.CC(C)C(=O)N1CCCC(CN)C1.CC(C)C(=O)N1CCCC(N)C1.CC(C)C(=O)N1CCCC1CN(C)C.CC(C)C(=O)N1CCCC1CN1CCCC1.CC(C)C(=O)N1CCCCC1CN.CC(C)C(=O)N1CCCCC1CN(C)C.CC(C)C(=O)N1CCCCC1CN1CCCC1.CCCC1CCCN1C(=O)C(C)C.CCCC1CCN(C(=O)C(C)C)CC1.CNCC1CCCCN1C(=O)C(C)C.CNCC1CCCN(C(=O)C(C)C)C1
InChIInChI=1S/C14H26N2O.C13H24N2O.3C12H24N2O.C12H23NO.4C11H22N2O.C11H21NO.3C10H20N2O.2C9H18N2O/c1-12(2)14(17)16-10-4-3-7-13(16)11-15-8-5-6-9-15;1-11(2)13(16)15-9-5-6-12(15)10-14-7-3-4-8-14;1-10(2)12(15)14-7-5-11(6-8-14)9-13(3)4;1-10(2)12(15)14-7-5-6-11(9-14)8-13(3)4;1-10(2)12(15)14-8-6-5-7-11(14)9-13(3)4;1-4-5-11-6-8-13(9-7-11)12(14)10(2)3;1-9(2)11(14)13-7-5-6-10(13)8-12(3)4;1-9(2)11(14)13-7-4-10(3-6-12)5-8-13;1-9(2)11(14)13-6-4-5-10(8-13)7-12-3;1-9(2)11(14)13-7-5-4-6-10(13)8-12-3;1-4-6-10-7-5-8-12(10)11(13)9(2)3;1-8(2)10(13)12-5-3-9(7-11)4-6-12;1-8(2)10(13)12-5-3-4-9(6-11)7-12;1-8(2)10(13)12-6-4-3-5-9(12)7-11;1-7(2)9(12)11-5-3-8(10)4-6-11;1-7(2)9(12)11-5-3-4-8(10)6-11/h12-13H,3-11H2,1-2H3;11-12H,3-10H2,1-2H3;3*10-11H,5-9H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,5-8H2,1-4H3;9-10H,3-8,12H2,1-2H3;2*9-10,12H,4-8H2,1-3H3;9-10H,4-8H2,1-3H3;3*8-9H,3-7,11H2,1-2H3;2*7-8H,3-6,10H2,1-2H3
InChIKeyARODAQVFSDKZHF-UHFFFAOYSA-N
MW3166.95 g/mol
LogP22.05
Rot. Bonds41

About 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one

1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one (PubChem CID 157207913) has the molecular formula C178H350N30O16 and a molecular weight of 3166.95 g/mol. Its IUPAC name is 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one.

Molecular Properties

Compound Name1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one
PubChem CID157207913
Molecular FormulaC178H350N30O16
Molecular Weight3166.95 g/mol
Exact Mass3164.75
IUPAC Name1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one
SMILESCC(C)C(=O)N1CCC(CCN)CC1.CC(C)C(=O)N1CCC(CN(C)C)CC1.CC(C)C(=O)N1CCC(CN)CC1.CC(C)C(=O)N1CCC(N)CC1.CC(C)C(=O)N1CCCC(CN(C)C)C1.CC(C)C(=O)N1CCCC(CN)C1.CC(C)C(=O)N1CCCC(N)C1.CC(C)C(=O)N1CCCC1CN(C)C.CC(C)C(=O)N1CCCC1CN1CCCC1.CC(C)C(=O)N1CCCCC1CN.CC(C)C(=O)N1CCCCC1CN(C)C.CC(C)C(=O)N1CCCCC1CN1CCCC1.CCCC1CCCN1C(=O)C(C)C.CCCC1CCN(C(=O)C(C)C)CC1.CNCC1CCCCN1C(=O)C(C)C.CNCC1CCCN(C(=O)C(C)C)C1
InChIInChI=1S/C14H26N2O.C13H24N2O.3C12H24N2O.C12H23NO.4C11H22N2O.C11H21NO.3C10H20N2O.2C9H18N2O/c1-12(2)14(17)16-10-4-3-7-13(16)11-15-8-5-6-9-15;1-11(2)13(16)15-9-5-6-12(15)10-14-7-3-4-8-14;1-10(2)12(15)14-7-5-11(6-8-14)9-13(3)4;1-10(2)12(15)14-7-5-6-11(9-14)8-13(3)4;1-10(2)12(15)14-8-6-5-7-11(14)9-13(3)4;1-4-5-11-6-8-13(9-7-11)12(14)10(2)3;1-9(2)11(14)13-7-5-6-10(13)8-12(3)4;1-9(2)11(14)13-7-4-10(3-6-12)5-8-13;1-9(2)11(14)13-6-4-5-10(8-13)7-12-3;1-9(2)11(14)13-7-5-4-6-10(13)8-12-3;1-4-6-10-7-5-8-12(10)11(13)9(2)3;1-8(2)10(13)12-5-3-9(7-11)4-6-12;1-8(2)10(13)12-5-3-4-9(6-11)7-12;1-8(2)10(13)12-6-4-3-5-9(12)7-11;1-7(2)9(12)11-5-3-8(10)4-6-11;1-7(2)9(12)11-5-3-4-8(10)6-11/h12-13H,3-11H2,1-2H3;11-12H,3-10H2,1-2H3;3*10-11H,5-9H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,5-8H2,1-4H3;9-10H,3-8,12H2,1-2H3;2*9-10,12H,4-8H2,1-3H3;9-10H,4-8H2,1-3H3;3*8-9H,3-7,11H2,1-2H3;2*7-8H,3-6,10H2,1-2H3
InChIKeyARODAQVFSDKZHF-UHFFFAOYSA-N
XLogP22.05
TPSA524.58 Ų
H-Bond Donors8
H-Bond Acceptors30
Rotatable Bonds41
Heavy Atoms224
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003166.95
LogP ≤ 522.05
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1030

Analyze 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one?
The IUPAC name of 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one (CID 157207913) is 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one.
What is the SMILES notation for 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one?
The canonical SMILES for 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one is CC(C)C(=O)N1CCC(CCN)CC1.CC(C)C(=O)N1CCC(CN(C)C)CC1.CC(C)C(=O)N1CCC(CN)CC1.CC(C)C(=O)N1CCC(N)CC1.CC(C)C(=O)N1CCCC(CN(C)C)C1.CC(C)C(=O)N1CCCC(CN)C1.CC(C)C(=O)N1CCCC(N)C1.CC(C)C(=O)N1CCCC1CN(C)C.CC(C)C(=O)N1CCCC1CN1CCCC1.CC(C)C(=O)N1CCCCC1CN.CC(C)C(=O)N1CCCCC1CN(C)C.CC(C)C(=O)N1CCCCC1CN1CCCC1.CCCC1CCCN1C(=O)C(C)C.CCCC1CCN(C(=O)C(C)C)CC1.CNCC1CCCCN1C(=O)C(C)C.CNCC1CCCN(C(=O)C(C)C)C1.
What is the InChIKey of 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one?
The InChIKey is ARODAQVFSDKZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O.C13H24N2O.3C12H24N2O.C12H23NO.4C11H22N2O.C11H21NO.3C10H20N2O.2C9H18N2O/c1-12(2)14(17)16-10-4-3-7-13(16)11-15-8-5-6-9-15;1-11(2)13(16)15-9-5-6-12(15)10-14-7-3-4-8-14;1-10(2)12(15)14-7-5-11(6-8-14)9-13(3)4;1-10(2)12(15)14-7-5-6-11(9-14)8-13(3)4;1-10(2)12(15)14-8-6-5-7-11(14)9-13(3)4;1-4-5-11-6-8-13(9-7-11)12(14)10(2)3;1-9(2)11(14)13-7-5-6-10(13)8-12(3)4;1-9(2)11(14)13-7-4-10(3-6-12)5-8-13;1-9(2)11(14)13-6-4-5-10(8-13)7-12-3;1-9(2)11(14)13-7-5-4-6-10(13)8-12-3;1-4-6-10-7-5-8-12(10)11(13)9(2)3;1-8(2)10(13)12-5-3-9(7-11)4-6-12;1-8(2)10(13)12-5-3-4-9(6-11)7-12;1-8(2)10(13)12-6-4-3-5-9(12)7-11;1-7(2)9(12)11-5-3-8(10)4-6-11;1-7(2)9(12)11-5-3-4-8(10)6-11/h12-13H,3-11H2,1-2H3;11-12H,3-10H2,1-2H3;3*10-11H,5-9H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,5-8H2,1-4H3;9-10H,3-8,12H2,1-2H3;2*9-10,12H,4-8H2,1-3H3;9-10H,4-8H2,1-3H3;3*8-9H,3-7,11H2,1-2H3;2*7-8H,3-6,10H2,1-2H3.
What are the key properties of 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one?
1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one has a molecular weight of 3166.95 g/mol, XLogP of 22.05, 41 rotatable bonds, 8 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[2-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[3-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-[4-(aminomethyl)piperidin-1-yl]-2-methylpropan-1-one;1-(3-aminopiperidin-1-yl)-2-methylpropan-1-one;1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one;2-methyl-1-[2-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[3-(methylaminomethyl)piperidin-1-yl]propan-1-one;2-methyl-1-(4-propylpiperidin-1-yl)propan-1-one;2-methyl-1-(2-propylpyrrolidin-1-yl)propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one;2-methyl-1-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-1-one is sourced from PubChem (CID 157207913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).