4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide

C19H29NO2 — CID 3823033

IUPAC4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide
SMILESCOc1ccc(CCCC(=O)NC2CCCCC2C)cc1C
InChIInChI=1S/C19H29NO2/c1-14-7-4-5-9-17(14)20-19(21)10-6-8-16-11-12-18(22-3)15(2)13-16/h11-14,17H,4-10H2,1-3H3,(H,20,21)
InChIKeyIDADHKJDWBLCBE-UHFFFAOYSA-N
MW303.45 g/mol
LogP4.02
Rot. Bonds6

About 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide

4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide (PubChem CID 3823033) has the molecular formula C19H29NO2 and a molecular weight of 303.45 g/mol. Its IUPAC name is 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide.

Molecular Properties

Compound Name4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide
PubChem CID3823033
Molecular FormulaC19H29NO2
Molecular Weight303.45 g/mol
Exact Mass303.22
IUPAC Name4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide
SMILESCOc1ccc(CCCC(=O)NC2CCCCC2C)cc1C
InChIInChI=1S/C19H29NO2/c1-14-7-4-5-9-17(14)20-19(21)10-6-8-16-11-12-18(22-3)15(2)13-16/h11-14,17H,4-10H2,1-3H3,(H,20,21)
InChIKeyIDADHKJDWBLCBE-UHFFFAOYSA-N
XLogP4.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dimethylphenyl)-N-(2-methylcyclohexyl)acetamide
CID 18157580
N-cyclopentyl-4-(3,4-dimethoxyphenyl)butanamide
CID 110407029
N-(2-bicyclo[2.2.1]heptanyl)-3-(4-methoxy-3-methylphenyl)propanamide
CID 133160744
N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide
CID 11470409
4-(2-methoxy-5-methylphenyl)-N-(2-methylcyclohexyl)-4-oxobutanamide
CID 108796049
N-cyclopropyl-4-(3,4-dimethoxyphenyl)butanamide
CID 110406403
N-[(1R,2S)-2-methylcyclohexyl]-2-(2,3,4-trimethoxyphenyl)acetamide
CID 9084467
N-[(4-methoxy-3-methylphenyl)methyl]-2-methylcyclopentan-1-amine
CID 55171660
N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[(1S,2R)-2-methylcyclohexyl]oxamide
CID 40720382
N-[(1S,2R)-2-methylcyclohexyl]-N'-[(1S,2S)-2-methylcyclohexyl]hexanediamide
CID 124778988
[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] 2-(3,4-dimethoxyphenyl)acetate
CID 7766228
2-(5-chloro-2-methoxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]acetamide
CID 9084409

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide?
The IUPAC name of 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide (CID 3823033) is 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide.
What is the SMILES notation for 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide?
The canonical SMILES for 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide is COc1ccc(CCCC(=O)NC2CCCCC2C)cc1C.
What is the InChIKey of 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide?
The InChIKey is IDADHKJDWBLCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO2/c1-14-7-4-5-9-17(14)20-19(21)10-6-8-16-11-12-18(22-3)15(2)13-16/h11-14,17H,4-10H2,1-3H3,(H,20,21).
What are the key properties of 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide?
4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide has a molecular weight of 303.45 g/mol, XLogP of 4.02, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide is sourced from PubChem (CID 3823033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).