N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide

C14H27NO2 — CID 79191579

IUPACN-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide
SMILESCCC1CCC(N(C)C(=O)CCC(C)O)CC1
InChIInChI=1S/C14H27NO2/c1-4-12-6-8-13(9-7-12)15(3)14(17)10-5-11(2)16/h11-13,16H,4-10H2,1-3H3
InChIKeyPEPYXJDFDUWVOL-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.57
Rot. Bonds5

About N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide

N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide (PubChem CID 79191579) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide
PubChem CID79191579
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide
SMILESCCC1CCC(N(C)C(=O)CCC(C)O)CC1
InChIInChI=1S/C14H27NO2/c1-4-12-6-8-13(9-7-12)15(3)14(17)10-5-11(2)16/h11-13,16H,4-10H2,1-3H3
InChIKeyPEPYXJDFDUWVOL-UHFFFAOYSA-N
XLogP2.57
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide
CID 79192601
4-[(4-ethylcyclohexyl)-methylamino]-4-oxobutanoic acid
CID 54907859
3-amino-N-(4-ethylcyclohexyl)-N-methylpropanamide
CID 61028395
2-[4-[methyl(4-methylpentanoyl)amino]cyclohexyl]acetic acid
CID 116817200
4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide
CID 79192365
3-[(4-ethylcyclohexyl)-methylamino]-2-methyl-3-oxopropanoic acid
CID 114897738
1-(4-ethylcyclohexyl)-1-methylurea
CID 61449062
4-[methyl(4-methylpentanoyl)amino]cyclohexane-1-carboxylic acid
CID 115277291
3-[(4-ethylcyclohexyl)-methylamino]butanoic acid
CID 61449261
4-(4-ethylcyclohexyl)butan-2-ol
CID 64774700
2-amino-N-(4-ethylcyclohexyl)-N,4-dimethylpentanamide
CID 54907811
5-amino-N,4-dimethyl-N-(4-methylcyclohexyl)pentanamide
CID 82011588

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide?
The IUPAC name of N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide (CID 79191579) is N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide.
What is the SMILES notation for N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide?
The canonical SMILES for N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide is CCC1CCC(N(C)C(=O)CCC(C)O)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide?
The InChIKey is PEPYXJDFDUWVOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-4-12-6-8-13(9-7-12)15(3)14(17)10-5-11(2)16/h11-13,16H,4-10H2,1-3H3.
What are the key properties of N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide?
N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide has a molecular weight of 241.37 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-4-hydroxy-N-methylpentanamide is sourced from PubChem (CID 79191579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).