N-cyclopropyl-3-methylhexanamide

C10H19NO — CID 155359047

IUPACN-cyclopropyl-3-methylhexanamide
SMILESCCCC(C)CC(=O)NC1CC1
InChIInChI=1S/C10H19NO/c1-3-4-8(2)7-10(12)11-9-5-6-9/h8-9H,3-7H2,1-2H3,(H,11,12)
InChIKeyAULRWOJCQJQNDK-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.09
Rot. Bonds5

About N-cyclopropyl-3-methylhexanamide

N-cyclopropyl-3-methylhexanamide (PubChem CID 155359047) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-cyclopropyl-3-methylhexanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-methylhexanamide
PubChem CID155359047
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-cyclopropyl-3-methylhexanamide
SMILESCCCC(C)CC(=O)NC1CC1
InChIInChI=1S/C10H19NO/c1-3-4-8(2)7-10(12)11-9-5-6-9/h8-9H,3-7H2,1-2H3,(H,11,12)
InChIKeyAULRWOJCQJQNDK-UHFFFAOYSA-N
XLogP2.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-N-piperidin-4-ylhexanamide;hydrochloride
CID 119388134
3-methyl-N-(2-methylpiperidin-4-yl)hexanamide
CID 120598747
4-amino-N-cyclobutyl-3-methylbutanamide
CID 81086885
3-amino-N-cyclopropylhexanamide;ethane;molecular hydrogen
CID 143418812
3-methyl-N-(3-methylcyclopentyl)pentanamide
CID 114875354
4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
(3S)-3-hydroxy-N-(4-methylcyclohexyl)butanamide
CID 89423792
3-methyl-N-piperidin-4-ylpentanamide
CID 112703814
3-amino-N-(4-methylcyclohexyl)butanamide
CID 60835833
5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid
CID 62965613
N-cyclopropyl-3,4,4-trimethylpentanamide
CID 63820853
2-[2-(cycloheptylamino)-2-oxoethyl]pentanoic acid
CID 112516456

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-methylhexanamide?
The IUPAC name of N-cyclopropyl-3-methylhexanamide (CID 155359047) is N-cyclopropyl-3-methylhexanamide.
What is the SMILES notation for N-cyclopropyl-3-methylhexanamide?
The canonical SMILES for N-cyclopropyl-3-methylhexanamide is CCCC(C)CC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-methylhexanamide?
The InChIKey is AULRWOJCQJQNDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-4-8(2)7-10(12)11-9-5-6-9/h8-9H,3-7H2,1-2H3,(H,11,12).
What are the key properties of N-cyclopropyl-3-methylhexanamide?
N-cyclopropyl-3-methylhexanamide has a molecular weight of 169.27 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-methylhexanamide is sourced from PubChem (CID 155359047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).