N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate

C82H159F3N14O13 — CID 162150081

IUPACN-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate
SMILESCC(C)C(C)C(=O)NC1CCN(C(C)C)CC1O.CC(C)CC(=O)NC1CN(C(C)C)CC1N.CC(C)N1CCC(NC(=O)C2(C(F)(F)F)CC2)C(O)C1.CC(C)N1CCC(NC(=O)C2(C)CCC2)C(O)C1.CC(C)N1CCC(NC(=O)OC(C)(C)C)C(OCCN(C)C)C1.CC(C)OC(=O)NC1CCN(C(C)C)CC1O
InChIInChI=1S/C17H35N3O3.C14H26N2O2.C14H28N2O2.C13H21F3N2O2.C12H25N3O.C12H24N2O3/c1-13(2)20-9-8-14(18-16(21)23-17(3,4)5)15(12-20)22-11-10-19(6)7;1-10(2)16-8-5-11(12(17)9-16)15-13(18)14(3)6-4-7-14;1-9(2)11(5)14(18)15-12-6-7-16(10(3)4)8-13(12)17;1-8(2)18-6-3-9(10(19)7-18)17-11(20)12(4-5-12)13(14,15)16;1-8(2)5-12(16)14-11-7-15(9(3)4)6-10(11)13;1-8(2)14-6-5-10(11(15)7-14)13-12(16)17-9(3)4/h13-15H,8-12H2,1-7H3,(H,18,21);10-12,17H,4-9H2,1-3H3,(H,15,18);9-13,17H,6-8H2,1-5H3,(H,15,18);8-10,19H,3-7H2,1-2H3,(H,17,20);8-11H,5-7,13H2,1-4H3,(H,14,16);8-11,15H,5-7H2,1-4H3,(H,13,16)
InChIKeyZLBXXQURLTXZMO-UHFFFAOYSA-N
MW1606.25 g/mol
LogP7.14
Rot. Bonds23

About N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate

N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate (PubChem CID 162150081) has the molecular formula C82H159F3N14O13 and a molecular weight of 1606.25 g/mol. Its IUPAC name is N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate.

Molecular Properties

Compound NameN-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate
PubChem CID162150081
Molecular FormulaC82H159F3N14O13
Molecular Weight1606.25 g/mol
Exact Mass1605.22
IUPAC NameN-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate
SMILESCC(C)C(C)C(=O)NC1CCN(C(C)C)CC1O.CC(C)CC(=O)NC1CN(C(C)C)CC1N.CC(C)N1CCC(NC(=O)C2(C(F)(F)F)CC2)C(O)C1.CC(C)N1CCC(NC(=O)C2(C)CCC2)C(O)C1.CC(C)N1CCC(NC(=O)OC(C)(C)C)C(OCCN(C)C)C1.CC(C)OC(=O)NC1CCN(C(C)C)CC1O
InChIInChI=1S/C17H35N3O3.C14H26N2O2.C14H28N2O2.C13H21F3N2O2.C12H25N3O.C12H24N2O3/c1-13(2)20-9-8-14(18-16(21)23-17(3,4)5)15(12-20)22-11-10-19(6)7;1-10(2)16-8-5-11(12(17)9-16)15-13(18)14(3)6-4-7-14;1-9(2)11(5)14(18)15-12-6-7-16(10(3)4)8-13(12)17;1-8(2)18-6-3-9(10(19)7-18)17-11(20)12(4-5-12)13(14,15)16;1-8(2)5-12(16)14-11-7-15(9(3)4)6-10(11)13;1-8(2)14-6-5-10(11(15)7-14)13-12(16)17-9(3)4/h13-15H,8-12H2,1-7H3,(H,18,21);10-12,17H,4-9H2,1-3H3,(H,15,18);9-13,17H,6-8H2,1-5H3,(H,15,18);8-10,19H,3-7H2,1-2H3,(H,17,20);8-11H,5-7,13H2,1-4H3,(H,14,16);8-11,15H,5-7H2,1-4H3,(H,13,16)
InChIKeyZLBXXQURLTXZMO-UHFFFAOYSA-N
XLogP7.14
TPSA331.91 Ų
H-Bond Donors11
H-Bond Acceptors21
Rotatable Bonds23
Heavy Atoms112
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001606.25
LogP ≤ 57.14
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1021

Analyze N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate with MolForge

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Related Compounds

N-(3-amino-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclobutane-1-carboxamide;2-methyl-N-[4-(2-morpholin-4-ylethoxymethyl)-1-propan-2-ylpiperidin-4-yl]propanamide;propan-2-yl N-[4-(hydroxymethyl)-1-propan-2-ylpiperidin-4-yl]carbamate;4,4,4-trifluoro-N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)butanamide
CID 157722953
N-(3-amino-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;1-hydroxy-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclopropane-1-carboxamide;N-[4-(hydroxymethyl)-1-propan-2-ylpiperidin-4-yl]-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclobutane-1-carboxamide;2-methyl-N-[4-(2-morpholin-4-ylethoxymethyl)-1-propan-2-ylpiperidin-4-yl]propanamide;4,4,4-trifluoro-N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)butanamide
CID 158217093
tert-butyl N-(4-methyl-1-propan-2-ylpiperidin-4-yl)carbamate;2-cyclopropyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)acetamide;2,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)butanamide;2-hydroxy-3-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)butanamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)propanamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclopropanecarboxamide;N-(3-methyl-1-propan-2-ylpyrrolidin-3-yl)cyclopropanecarboxamide;2-methylpropyl N-(4-methyl-1-propan-2-ylpiperidin-4-yl)carbamate;propan-2-yl N-(4-methyl-1-propan-2-ylpiperidin-4-yl)carbamate;3,3,3-trifluoro-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)propanamide
CID 158218800
N-(3-amino-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;1-(dimethylamino)-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclopentane-1-carboxamide;1-hydroxy-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclopropane-1-carboxamide;N-[4-(hydroxymethyl)-1-propan-2-ylpiperidin-4-yl]-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclobutane-1-carboxamide;2-methyl-N-[4-(2-morpholin-4-ylethoxymethyl)-1-propan-2-ylpiperidin-4-yl]propanamide;4,4,4-trifluoro-N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)butanamide
CID 159040820
N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;2-cyclopropyl-N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]acetamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate
CID 159732931
2-cyclopropyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)acetamide;3,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)butanamide;2-hydroxy-3-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)butanamide;3-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)butanamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)propanamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclopropanecarboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)propanamide;N-(3-methyl-1-propan-2-ylpyrrolidin-3-yl)cyclopropanecarboxamide;2-methylpropyl N-(4-methyl-1-propan-2-ylpiperidin-4-yl)carbamate;propan-2-yl N-(4-methyl-1-propan-2-ylpiperidin-4-yl)carbamate;3,3,3-trifluoro-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)propanamide
CID 160120205
N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;2-cyclopropyl-N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]acetamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate
CID 160365827
2-cyclopropyl-N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]acetamide;cyclopropylmethyl N-[4-[(dimethylamino)methyl]-1-propan-2-ylpiperidin-4-yl]carbamate;N-[4-[(dimethylamino)methyl]-1-propan-2-ylpiperidin-4-yl]-2,3-dimethylbutanamide;N-[4-[(dimethylamino)methyl]-1-propan-2-ylpiperidin-4-yl]-2-(1-methoxycyclopropyl)acetamide;2,3-dimethyl-N-[4-(morpholin-4-ylmethyl)-1-propan-2-ylpiperidin-4-yl]butanamide;N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]-2,3-dimethylbutanamide;N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide
CID 161005109
N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;2-cyclopropyl-N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]acetamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate
CID 162166184
2-cyclopropyl-N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]acetamide;N-[4-[(dimethylamino)methyl]-1-propan-2-ylpiperidin-4-yl]-2,3-dimethylbutanamide;N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]-2,3-dimethylbutanamide;N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide
CID 162205605
N-(3-amino-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;N-[4-(hydroxymethyl)-1-propan-2-ylpiperidin-4-yl]-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)cyclobutane-1-carboxamide;2-methyl-N-[4-(2-morpholin-4-ylethoxymethyl)-1-propan-2-ylpiperidin-4-yl]propanamide;4,4,4-trifluoro-N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)butanamide
CID 167585094
2-cyclopropyl-N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]acetamide;N-[4-[(dimethylamino)methyl]-1-propan-2-ylpiperidin-4-yl]-3-methylbutanamide;N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]-2,3-dimethylbutanamide;N-[4-[(4-ethylpiperazin-1-yl)methyl]-1-propan-2-ylpiperidin-4-yl]-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-3-methylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide
CID 167675056

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate?
The IUPAC name of N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate (CID 162150081) is N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate.
What is the SMILES notation for N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate?
The canonical SMILES for N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate is CC(C)C(C)C(=O)NC1CCN(C(C)C)CC1O.CC(C)CC(=O)NC1CN(C(C)C)CC1N.CC(C)N1CCC(NC(=O)C2(C(F)(F)F)CC2)C(O)C1.CC(C)N1CCC(NC(=O)C2(C)CCC2)C(O)C1.CC(C)N1CCC(NC(=O)OC(C)(C)C)C(OCCN(C)C)C1.CC(C)OC(=O)NC1CCN(C(C)C)CC1O.
What is the InChIKey of N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate?
The InChIKey is ZLBXXQURLTXZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3O3.C14H26N2O2.C14H28N2O2.C13H21F3N2O2.C12H25N3O.C12H24N2O3/c1-13(2)20-9-8-14(18-16(21)23-17(3,4)5)15(12-20)22-11-10-19(6)7;1-10(2)16-8-5-11(12(17)9-16)15-13(18)14(3)6-4-7-14;1-9(2)11(5)14(18)15-12-6-7-16(10(3)4)8-13(12)17;1-8(2)18-6-3-9(10(19)7-18)17-11(20)12(4-5-12)13(14,15)16;1-8(2)5-12(16)14-11-7-15(9(3)4)6-10(11)13;1-8(2)14-6-5-10(11(15)7-14)13-12(16)17-9(3)4/h13-15H,8-12H2,1-7H3,(H,18,21);10-12,17H,4-9H2,1-3H3,(H,15,18);9-13,17H,6-8H2,1-5H3,(H,15,18);8-10,19H,3-7H2,1-2H3,(H,17,20);8-11H,5-7,13H2,1-4H3,(H,14,16);8-11,15H,5-7H2,1-4H3,(H,13,16).
What are the key properties of N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate?
N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate has a molecular weight of 1606.25 g/mol, XLogP of 7.14, 23 rotatable bonds, 11 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1-propan-2-ylpyrrolidin-3-yl)-3-methylbutanamide;tert-butyl N-[3-[2-(dimethylamino)ethoxy]-1-propan-2-ylpiperidin-4-yl]carbamate;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-2,3-dimethylbutanamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-methylcyclobutane-1-carboxamide;N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide;propan-2-yl N-(3-hydroxy-1-propan-2-ylpiperidin-4-yl)carbamate is sourced from PubChem (CID 162150081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).