2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide

C13H26N2O — CID 79870952

IUPAC2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide
SMILESCCCC(CN)C(=O)NC1CCCC1(C)C
InChIInChI=1S/C13H26N2O/c1-4-6-10(9-14)12(16)15-11-7-5-8-13(11,2)3/h10-11H,4-9,14H2,1-3H3,(H,15,16)
InChIKeySHNGLLWCTUZARP-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.06
Rot. Bonds5

About 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide

2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide (PubChem CID 79870952) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide
PubChem CID79870952
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide
SMILESCCCC(CN)C(=O)NC1CCCC1(C)C
InChIInChI=1S/C13H26N2O/c1-4-6-10(9-14)12(16)15-11-7-5-8-13(11,2)3/h10-11H,4-9,14H2,1-3H3,(H,15,16)
InChIKeySHNGLLWCTUZARP-UHFFFAOYSA-N
XLogP2.06
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2,2-dimethylcyclohexyl)pentanamide
CID 79877969
(2S)-2-amino-N-(2,2-dimethylcyclopentyl)hexanamide
CID 103831777
2-(aminomethyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)pentanamide
CID 114629813
N-(2,2-dimethylcyclopentyl)-2-(N'-hydroxycarbamimidoyl)pentanamide
CID 79872575
N-(2,2-dimethylcyclopentyl)-2-sulfanylbutanamide
CID 131177062
(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide
CID 79878292
1-(2,2-dimethylcyclopentyl)-3-(2-hydroxypentyl)urea
CID 111841149
2-(aminomethyl)-N-[4-(trifluoromethyl)cyclohexyl]pentanamide
CID 65225132
2-[2-(aminomethyl)pentanoylamino]cyclohexane-1-carboxylic acid
CID 65228027
2-(aminomethyl)-N-(2-methylcyclopropyl)pentanamide
CID 62397144
N-(2,2-dimethylcyclopentyl)propanamide;ethane
CID 171523007
4-amino-5-[(2,2-dimethylcyclohexyl)amino]-5-oxopentanoic acid
CID 79878132

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide?
The IUPAC name of 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide (CID 79870952) is 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide?
The canonical SMILES for 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide is CCCC(CN)C(=O)NC1CCCC1(C)C.
What is the InChIKey of 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide?
The InChIKey is SHNGLLWCTUZARP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-6-10(9-14)12(16)15-11-7-5-8-13(11,2)3/h10-11H,4-9,14H2,1-3H3,(H,15,16).
What are the key properties of 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide?
2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide has a molecular weight of 226.36 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide is sourced from PubChem (CID 79870952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).