2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide

C13H26N2O2 — CID 55086703

IUPAC2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC1(CO)CCCCC1
InChIInChI=1S/C13H26N2O2/c1-3-7-12(2,14)11(17)15-13(10-16)8-5-4-6-9-13/h16H,3-10,14H2,1-2H3,(H,15,17)
InChIKeyUSALMWAUVFTFPX-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.32
Rot. Bonds5

About 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide

2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide (PubChem CID 55086703) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide
PubChem CID55086703
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC1(CO)CCCCC1
InChIInChI=1S/C13H26N2O2/c1-3-7-12(2,14)11(17)15-13(10-16)8-5-4-6-9-13/h16H,3-10,14H2,1-2H3,(H,15,17)
InChIKeyUSALMWAUVFTFPX-UHFFFAOYSA-N
XLogP1.32
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpropanamide
CID 62550986
1-[(2-amino-2-methylpentanoyl)amino]cyclohexane-1-carboxylic acid
CID 61158529
N-[1-(hydroxymethyl)cyclopentyl]-2,2-dimethylbutanamide
CID 62679590
2-amino-N-[[1-(2-hydroxyethyl)cyclopentyl]methyl]-2-methylpentanamide
CID 119817843
2-amino-N-[4-(hydroxymethyl)oxan-4-yl]-2-methylbutanamide
CID 106298541
1-[[(2-amino-2-methylpentanoyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 113311179
2-bromo-N-[1-(hydroxymethyl)cyclobutyl]-2-methylpropanamide
CID 114329200
2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride
CID 119820346
2-amino-2-methyl-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride
CID 119699195
2-amino-N-(cyclooctylmethyl)-2-methylpentanamide;hydrochloride
CID 119741898
N-(1-ethylcyclopentyl)-2,2-dimethylpropanamide
CID 58542277
4-[[(2-amino-2-methylpentanoyl)amino]methyl]oxane-4-carboxylic acid
CID 115439956

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide?
The IUPAC name of 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide (CID 55086703) is 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide?
The canonical SMILES for 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide is CCCC(C)(N)C(=O)NC1(CO)CCCCC1.
What is the InChIKey of 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide?
The InChIKey is USALMWAUVFTFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-3-7-12(2,14)11(17)15-13(10-16)8-5-4-6-9-13/h16H,3-10,14H2,1-2H3,(H,15,17).
What are the key properties of 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide?
2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide has a molecular weight of 242.36 g/mol, XLogP of 1.32, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-methylpentanamide is sourced from PubChem (CID 55086703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).