3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide

C15H29N3O — CID 119866673

IUPAC3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide
SMILESCC(C)N1CCCC(CNC(=O)C2CCC(N)C2)C1
InChIInChI=1S/C15H29N3O/c1-11(2)18-7-3-4-12(10-18)9-17-15(19)13-5-6-14(16)8-13/h11-14H,3-10,16H2,1-2H3,(H,17,19)
InChIKeyGHJZZFRRXMCTHA-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.35
Rot. Bonds4

About 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide

3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide (PubChem CID 119866673) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide
PubChem CID119866673
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide
SMILESCC(C)N1CCCC(CNC(=O)C2CCC(N)C2)C1
InChIInChI=1S/C15H29N3O/c1-11(2)18-7-3-4-12(10-18)9-17-15(19)13-5-6-14(16)8-13/h11-14H,3-10,16H2,1-2H3,(H,17,19)
InChIKeyGHJZZFRRXMCTHA-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S,4R)-2-azabicyclo(2.2.1)heptan-3-one
CID 2734523
2-Azabicyclo(2.2.1)heptan-3-one
CID 13078198
(1R,4S)-2-azabicyclo(2.2.1)heptan-3-one
CID 55250818
2-Piperidone, 5,6-dimethyl-4-isopropyl-, hydrochloride
CID 3051329
Pentanamide, N-4-piperidinyl-2-propyl-
CID 3075850
Cyclopentanecarboxylic acid piperidin-4-ylamide
CID 3163332
N,N-diethyl-3-(piperidin-4-yl)propanamide
CID 17803282
N-methyl-N-(propan-2-yl)piperidine-3-carboxamide
CID 18073102
N-butyl-6-methylpiperidine-3-carboxamide
CID 24693888
5-(Aminomethyl)-6-methylpiperidin-2-one hydrochloride
CID 121552965
rac-(3R,6R)-3-ethyl-6-methylpiperidin-2-one
CID 122155636
4-(Aminomethyl)-6-methylpiperidin-2-one dihydrochloride
CID 122164378

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide (CID 119866673) is 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide is CC(C)N1CCCC(CNC(=O)C2CCC(N)C2)C1.
What is the InChIKey of 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide?
The InChIKey is GHJZZFRRXMCTHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-11(2)18-7-3-4-12(10-18)9-17-15(19)13-5-6-14(16)8-13/h11-14H,3-10,16H2,1-2H3,(H,17,19).
What are the key properties of 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide?
3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(1-propan-2-ylpiperidin-3-yl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119866673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).