2-(4-methylcyclohexyl)propanamide

C10H19NO — CID 175989942

IUPAC2-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(C(C)C(N)=O)CC1
InChIInChI=1S/C10H19NO/c1-7-3-5-9(6-4-7)8(2)10(11)12/h7-9H,3-6H2,1-2H3,(H2,11,12)
InChIKeyNQRDUXQRHWWTQH-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.93
Rot. Bonds2

About 2-(4-methylcyclohexyl)propanamide

2-(4-methylcyclohexyl)propanamide (PubChem CID 175989942) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-(4-methylcyclohexyl)propanamide.

Molecular Properties

Compound Name2-(4-methylcyclohexyl)propanamide
PubChem CID175989942
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(C(C)C(N)=O)CC1
InChIInChI=1S/C10H19NO/c1-7-3-5-9(6-4-7)8(2)10(11)12/h7-9H,3-6H2,1-2H3,(H2,11,12)
InChIKeyNQRDUXQRHWWTQH-UHFFFAOYSA-N
XLogP1.93
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-hydroxycyclohexyl)propanamide
CID 90285777
(2R)-2-(4-methylcyclohexyl)propanoic acid
CID 96631531
carbamic acid;1-methyl-4-propan-2-ylcyclohexane
CID 67059714
methyl 2-(4-methylcyclohexyl)propanoate
CID 22035514
lithium;2-cyclohexylpropanamide;hydride
CID 173193796
methyl 2-amino-2-(4-methylcyclohexyl)acetate
CID 64747912
(2S)-2-amino-2-(4-methylcyclohexyl)acetic acid
CID 57462435
dimethyl 2-(4-methylcyclohexyl)propanedioate
CID 103972492
(2-cyclopropylpropanoylamino)urea
CID 83150747
methane;1-methyl-4-propan-2-ylcyclohexane
CID 178082994
carbamic acid;methylcyclopropane;hydrochloride
CID 175193332
1-methyl-4-[3-(4-methylcyclohexyl)butan-2-yl]cyclohexane
CID 123821196

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylcyclohexyl)propanamide?
The IUPAC name of 2-(4-methylcyclohexyl)propanamide (CID 175989942) is 2-(4-methylcyclohexyl)propanamide.
What is the SMILES notation for 2-(4-methylcyclohexyl)propanamide?
The canonical SMILES for 2-(4-methylcyclohexyl)propanamide is CC1CCC(C(C)C(N)=O)CC1.
What is the InChIKey of 2-(4-methylcyclohexyl)propanamide?
The InChIKey is NQRDUXQRHWWTQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7-3-5-9(6-4-7)8(2)10(11)12/h7-9H,3-6H2,1-2H3,(H2,11,12).
What are the key properties of 2-(4-methylcyclohexyl)propanamide?
2-(4-methylcyclohexyl)propanamide has a molecular weight of 169.27 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylcyclohexyl)propanamide is sourced from PubChem (CID 175989942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).