4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide

C13H25NO2 — CID 79192365

IUPAC4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide
SMILESCC(O)CCC(=O)N(C)C1CCCC(C)C1
InChIInChI=1S/C13H25NO2/c1-10-5-4-6-12(9-10)14(3)13(16)8-7-11(2)15/h10-12,15H,4-9H2,1-3H3
InChIKeyGUYKZEACZUAAQD-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.18
Rot. Bonds4

About 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide

4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide (PubChem CID 79192365) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide
PubChem CID79192365
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide
SMILESCC(O)CCC(=O)N(C)C1CCCC(C)C1
InChIInChI=1S/C13H25NO2/c1-10-5-4-6-12(9-10)14(3)13(16)8-7-11(2)15/h10-12,15H,4-9H2,1-3H3
InChIKeyGUYKZEACZUAAQD-UHFFFAOYSA-N
XLogP2.18
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-methyl-N-(3-methylcyclohexyl)butanamide
CID 61447077
7-amino-N-methyl-N-(3-methylcyclohexyl)heptanamide
CID 54949044
N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide
CID 79191579
N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide
CID 79192601
N-methyl-N-[(3S)-3-methylcyclohexyl]acetamide
CID 169132453
N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide
CID 119717321
5-[[methyl-(3-methylcyclohexyl)carbamoyl]amino]hexanoic acid
CID 82848247
2-(cyclopentylamino)-N-methyl-N-(3-methylcyclohexyl)acetamide
CID 54948955
2-amino-N,3-dimethyl-N-(3-methylcyclohexyl)butanamide
CID 59011420
2-methyl-4-[[methyl-(3-methylcyclohexyl)carbamoyl]amino]butanoic acid
CID 80541792
(2S)-2-hydroxy-4-[[methyl-(3-methylcyclohexyl)carbamoyl]amino]butanoic acid
CID 114007276
2-amino-N-methyl-N-(3-methylcyclohexyl)pentanamide;hydrochloride
CID 119285987

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide?
The IUPAC name of 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide (CID 79192365) is 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide?
The canonical SMILES for 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide is CC(O)CCC(=O)N(C)C1CCCC(C)C1.
What is the InChIKey of 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide?
The InChIKey is GUYKZEACZUAAQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-10-5-4-6-12(9-10)14(3)13(16)8-7-11(2)15/h10-12,15H,4-9H2,1-3H3.
What are the key properties of 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide?
4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide has a molecular weight of 227.35 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide is sourced from PubChem (CID 79192365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).