5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide

C13H26N2O2 — CID 102631912

IUPAC5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide
SMILESCC(CN)CCC(=O)N(C)C1CCCCC1O
InChIInChI=1S/C13H26N2O2/c1-10(9-14)7-8-13(17)15(2)11-5-3-4-6-12(11)16/h10-12,16H,3-9,14H2,1-2H3
InChIKeyVNVSFYOIOYNYMZ-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.12
Rot. Bonds5

About 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide

5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide (PubChem CID 102631912) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide.

Molecular Properties

Compound Name5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide
PubChem CID102631912
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide
SMILESCC(CN)CCC(=O)N(C)C1CCCCC1O
InChIInChI=1S/C13H26N2O2/c1-10(9-14)7-8-13(17)15(2)11-5-3-4-6-12(11)16/h10-12,16H,3-9,14H2,1-2H3
InChIKeyVNVSFYOIOYNYMZ-UHFFFAOYSA-N
XLogP1.12
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N,4-dimethyl-N-(4-methylcyclohexyl)pentanamide
CID 82011588
2-(1-aminocyclobutyl)-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 102632099
3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide
CID 102632066
2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide
CID 102631962
3-amino-N-(2-hydroxycyclohexyl)-2-methoxy-N-methylpropanamide
CID 106114022
2-cyclobutyl-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 103164780
N-(2-hydroxycyclohexyl)-2-methoxy-N-methylacetamide
CID 102634610
2-cycloheptyl-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 102635605
N-(2-chlorocyclohexyl)-N,4-dimethylpentanamide
CID 102637926
N-(2-hydroxycyclohexyl)-N,2-dimethylpentanamide
CID 102634854
2-(4-ethylphenyl)-N-[(1R,2S)-2-hydroxycyclohexyl]-N-methylacetamide
CID 95397472
(2R)-2-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide
CID 102631964

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide?
The IUPAC name of 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide (CID 102631912) is 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide.
What is the SMILES notation for 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide?
The canonical SMILES for 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide is CC(CN)CCC(=O)N(C)C1CCCCC1O.
What is the InChIKey of 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide?
The InChIKey is VNVSFYOIOYNYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(9-14)7-8-13(17)15(2)11-5-3-4-6-12(11)16/h10-12,16H,3-9,14H2,1-2H3.
What are the key properties of 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide?
5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide has a molecular weight of 242.36 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide is sourced from PubChem (CID 102631912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).