3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine

C150H328N34 — CID 160522983

IUPAC3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine
SMILESCC(C)N1CCC(N2CCCC2)C1.CC(C)N1CCCNCC1.CC(C)N1CCN(C)CC1.CC(C)N1CCNC(C)(C)C1.CC(C)N1CCNC2(CC2)C1.CC(C)N1CCNCC1.CC(C)N1CCN[C@@H](C)C1.CC(C)N1CCN[C@H](C)C1.CC(C)N1CC[C@H](N2CCCC2)C1.CC(C)N1C[C@@H](C)N[C@@H](C)C1.CC(C)N1C[C@@H](C)N[C@@H](C)C1.CC(C)N1C[C@H](C)N[C@@H](C)C1.CC1CN(C(C)C)CC(C)N1.CC1CN(C(C)C)CCN1.CCC1CN(C(C)C)CCN1.CC[C@@H]1CN(C(C)C)CCN1.CC[C@H]1CN(C(C)C)CCN1
InChIInChI=1S/2C11H22N2.C9H18N2.8C9H20N2.5C8H18N2.C7H16N2/c2*1-10(2)13-8-5-11(9-13)12-6-3-4-7-12;1-8(2)11-6-5-10-9(7-11)3-4-9;4*1-7(2)11-5-8(3)10-9(4)6-11;1-8(2)11-6-5-10-9(3,4)7-11;3*1-4-9-7-11(8(2)3)6-5-10-9;1-8(2)10-6-4-9(3)5-7-10;3*1-7(2)10-5-4-9-8(3)6-10;1-8(2)10-6-3-4-9-5-7-10;1-7(2)9-5-3-8-4-6-9/h2*10-11H,3-9H2,1-2H3;8,10H,3-7H2,1-2H3;4*7-10H,5-6H2,1-4H3;8,10H,5-7H2,1-4H3;3*8-10H,4-7H2,1-3H3;8H,4-7H2,1-3H3;3*7-9H,4-6H2,1-3H3;8-9H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3/t11-;;;2*8-,9+;8-,9-;;;2*9-;;;2*8-;;;/m0....0..10..10.../s1
InChIKeyQUNGFWSYJDEPPX-UDQISNIGSA-N
MW2608.51 g/mol
LogP16.28
Rot. Bonds22

About 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine

3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine (PubChem CID 160522983) has the molecular formula C150H328N34 and a molecular weight of 2608.51 g/mol. Its IUPAC name is 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine.

Molecular Properties

Compound Name3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine
PubChem CID160522983
Molecular FormulaC150H328N34
Molecular Weight2608.51 g/mol
Exact Mass2606.67
IUPAC Name3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine
SMILESCC(C)N1CCC(N2CCCC2)C1.CC(C)N1CCCNCC1.CC(C)N1CCN(C)CC1.CC(C)N1CCNC(C)(C)C1.CC(C)N1CCNC2(CC2)C1.CC(C)N1CCNCC1.CC(C)N1CCN[C@@H](C)C1.CC(C)N1CCN[C@H](C)C1.CC(C)N1CC[C@H](N2CCCC2)C1.CC(C)N1C[C@@H](C)N[C@@H](C)C1.CC(C)N1C[C@@H](C)N[C@@H](C)C1.CC(C)N1C[C@H](C)N[C@@H](C)C1.CC1CN(C(C)C)CC(C)N1.CC1CN(C(C)C)CCN1.CCC1CN(C(C)C)CCN1.CC[C@@H]1CN(C(C)C)CCN1.CC[C@H]1CN(C(C)C)CCN1
InChIInChI=1S/2C11H22N2.C9H18N2.8C9H20N2.5C8H18N2.C7H16N2/c2*1-10(2)13-8-5-11(9-13)12-6-3-4-7-12;1-8(2)11-6-5-10-9(7-11)3-4-9;4*1-7(2)11-5-8(3)10-9(4)6-11;1-8(2)11-6-5-10-9(3,4)7-11;3*1-4-9-7-11(8(2)3)6-5-10-9;1-8(2)10-6-4-9(3)5-7-10;3*1-7(2)10-5-4-9-8(3)6-10;1-8(2)10-6-3-4-9-5-7-10;1-7(2)9-5-3-8-4-6-9/h2*10-11H,3-9H2,1-2H3;8,10H,3-7H2,1-2H3;4*7-10H,5-6H2,1-4H3;8,10H,5-7H2,1-4H3;3*8-10H,4-7H2,1-3H3;8H,4-7H2,1-3H3;3*7-9H,4-6H2,1-3H3;8-9H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3/t11-;;;2*8-,9+;8-,9-;;;2*9-;;;2*8-;;;/m0....0..10..10.../s1
InChIKeyQUNGFWSYJDEPPX-UDQISNIGSA-N
XLogP16.28
TPSA233.22 Ų
H-Bond Donors14
H-Bond Acceptors34
Rotatable Bonds22
Heavy Atoms184
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002608.51
LogP ≤ 516.28
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1034

Analyze 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine with MolForge

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Launch Full Analysis

Related Compounds

1-cyclopropyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,3-dimethylpiperazine;1,4-dimethylpiperazine;2,4-dimethyl-1-propan-2-ylpiperazine;1-ethyl-4-methylpiperazine;2-methyl-2,5-diazabicyclo[2.2.1]heptane;3-methyl-3,8-diazabicyclo[3.2.1]octane;1-methylpiperazine;4-methylpiperidine;2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;1-methyl-4-propan-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,2,4-trimethylpiperazine;1,3,3-trimethylpiperazine;1,3,5-trimethylpiperazine;N,N,1-trimethylpiperidin-4-amine;2,2,4-trimethyl-1-propan-2-ylpiperazine
CID 157945178
CID 158315073
CID 158315073
8a-methyl-2-propan-2-yl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine;3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;2-propan-2-yl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine
CID 158670066
CID 160584436
CID 160584436
CID 160773093
CID 160773093
(1S,5R)-8-tert-butyl-3-methyl-3,8-diazabicyclo[3.2.1]octane;1-tert-butylpyrrolidine;carbanide;ethane;(2S)-2-methyl-1-propan-2-ylpiperazin-4-ide;(1S,4S)-2-propan-2-yl-2-aza-5-azanidabicyclo[2.2.1]heptane;1-propan-2-ylpiperazin-4-ide;1-propan-2-ylpiperidine;tetrakis(yttrium)
CID 161053301
N,N-diethylpropan-2-amine;N,N-diethyl-1-propan-2-ylpyrrolidin-3-amine;N,N-dimethylpropan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;N-ethyl-N-methylpropan-2-amine;N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;bis(N-ethylpropan-2-amine);1-ethyl-4-propan-2-ylpiperazine;N-methylpropan-2-amine;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylazetidine;N-propan-2-ylbutan-2-amine;N-propan-2-ylcyclopropanamine;tris(1-propan-2-ylpiperidine);N-propan-2-ylpropan-2-amine;1-propan-2-ylpyrrolidine
CID 161087959
N,N-diethylpropan-2-amine;N,N-diethyl-1-propan-2-ylpyrrolidin-3-amine;N,N-dimethylpropan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;bis(N-ethylpropan-2-amine);1-ethyl-4-propan-2-ylpiperazine;N-methylpropan-2-amine;N-methyl-N-propan-2-ylcyclopropanamine;1-methyl-4-propan-2-ylpiperazine;N-methyl-N-propan-2-ylpropan-1-amine;1-propan-2-ylazetidine;tris(1-propan-2-ylpiperidine);N-propan-2-ylpropan-1-amine;N-propan-2-ylpropan-2-amine;1-propan-2-ylpyrrolidine
CID 161715739
N,N-diethylpropan-2-amine;N,N-diethyl-1-propan-2-ylpyrrolidin-3-amine;N,N-dimethylpropan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;N-ethyl-N-methylpropan-2-amine;N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;bis(N-ethylpropan-2-amine);1-ethyl-4-propan-2-ylpiperazine;N-methylpropan-2-amine;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylazetidine;N-propan-2-ylcyclopropanamine;tris(1-propan-2-ylpiperidine);N-propan-2-ylpropan-1-amine;N-propan-2-ylpropan-2-amine;1-propan-2-ylpyrrolidine
CID 161748659
N,N-diethylpropan-2-amine;N,N-diethyl-1-propan-2-ylpyrrolidin-3-amine;N,N-dimethylpropan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;N-ethyl-N-methylpropan-2-amine;N-ethyl-N-methyl-1-propan-2-ylpyrrolidin-3-amine;bis(N-ethylpropan-2-amine);1-ethyl-4-propan-2-ylpiperazine;methane;N-methylpropan-2-amine;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylazetidine;N-propan-2-ylcyclopropanamine;tris(1-propan-2-ylpiperidine);N-propan-2-ylpropan-1-amine;N-propan-2-ylpropan-2-amine;1-propan-2-ylpyrrolidine
CID 162207593

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine?
The IUPAC name of 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine (CID 160522983) is 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine.
What is the SMILES notation for 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine?
The canonical SMILES for 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine is CC(C)N1CCC(N2CCCC2)C1.CC(C)N1CCCNCC1.CC(C)N1CCN(C)CC1.CC(C)N1CCNC(C)(C)C1.CC(C)N1CCNC2(CC2)C1.CC(C)N1CCNCC1.CC(C)N1CCN[C@@H](C)C1.CC(C)N1CCN[C@H](C)C1.CC(C)N1CC[C@H](N2CCCC2)C1.CC(C)N1C[C@@H](C)N[C@@H](C)C1.CC(C)N1C[C@@H](C)N[C@@H](C)C1.CC(C)N1C[C@H](C)N[C@@H](C)C1.CC1CN(C(C)C)CC(C)N1.CC1CN(C(C)C)CCN1.CCC1CN(C(C)C)CCN1.CC[C@@H]1CN(C(C)C)CCN1.CC[C@H]1CN(C(C)C)CCN1.
What is the InChIKey of 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine?
The InChIKey is QUNGFWSYJDEPPX-UDQISNIGSA-N. The full InChI is InChI=1S/2C11H22N2.C9H18N2.8C9H20N2.5C8H18N2.C7H16N2/c2*1-10(2)13-8-5-11(9-13)12-6-3-4-7-12;1-8(2)11-6-5-10-9(7-11)3-4-9;4*1-7(2)11-5-8(3)10-9(4)6-11;1-8(2)11-6-5-10-9(3,4)7-11;3*1-4-9-7-11(8(2)3)6-5-10-9;1-8(2)10-6-4-9(3)5-7-10;3*1-7(2)10-5-4-9-8(3)6-10;1-8(2)10-6-3-4-9-5-7-10;1-7(2)9-5-3-8-4-6-9/h2*10-11H,3-9H2,1-2H3;8,10H,3-7H2,1-2H3;4*7-10H,5-6H2,1-4H3;8,10H,5-7H2,1-4H3;3*8-10H,4-7H2,1-3H3;8H,4-7H2,1-3H3;3*7-9H,4-6H2,1-3H3;8-9H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3/t11-;;;2*8-,9+;8-,9-;;;2*9-;;;2*8-;;;/m0....0..10..10.../s1.
What are the key properties of 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine?
3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine has a molecular weight of 2608.51 g/mol, XLogP of 16.28, 22 rotatable bonds, 14 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;(3S,5S)-3,5-dimethyl-1-propan-2-ylpiperazine;bis((3R,5S)-3,5-dimethyl-1-propan-2-ylpiperazine);3-ethyl-1-propan-2-ylpiperazine;(3R)-3-ethyl-1-propan-2-ylpiperazine;(3S)-3-ethyl-1-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpiperazine;(3R)-3-methyl-1-propan-2-ylpiperazine;(3S)-3-methyl-1-propan-2-ylpiperazine;7-propan-2-yl-4,7-diazaspiro[2.5]octane;1-propan-2-yl-1,4-diazepane;1-propan-2-ylpiperazine;1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine;(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine is sourced from PubChem (CID 160522983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).