N-cyclohexyl-3-(4-methoxyphenyl)propanamide

C16H23NO2 — CID 4590252

IUPACN-cyclohexyl-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C16H23NO2/c1-19-15-10-7-13(8-11-15)9-12-16(18)17-14-5-3-2-4-6-14/h7-8,10-11,14H,2-6,9,12H2,1H3,(H,17,18)
InChIKeyKGUCCBNJKZQTMT-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.08
Rot. Bonds5

About N-cyclohexyl-3-(4-methoxyphenyl)propanamide

N-cyclohexyl-3-(4-methoxyphenyl)propanamide (PubChem CID 4590252) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-cyclohexyl-3-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(4-methoxyphenyl)propanamide
PubChem CID4590252
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC NameN-cyclohexyl-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C16H23NO2/c1-19-15-10-7-13(8-11-15)9-12-16(18)17-14-5-3-2-4-6-14/h7-8,10-11,14H,2-6,9,12H2,1H3,(H,17,18)
InChIKeyKGUCCBNJKZQTMT-UHFFFAOYSA-N
XLogP3.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(4-methoxyphenyl)propanamide?
The IUPAC name of N-cyclohexyl-3-(4-methoxyphenyl)propanamide (CID 4590252) is N-cyclohexyl-3-(4-methoxyphenyl)propanamide.
What is the SMILES notation for N-cyclohexyl-3-(4-methoxyphenyl)propanamide?
The canonical SMILES for N-cyclohexyl-3-(4-methoxyphenyl)propanamide is COc1ccc(CCC(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-3-(4-methoxyphenyl)propanamide?
The InChIKey is KGUCCBNJKZQTMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-19-15-10-7-13(8-11-15)9-12-16(18)17-14-5-3-2-4-6-14/h7-8,10-11,14H,2-6,9,12H2,1H3,(H,17,18).
What are the key properties of N-cyclohexyl-3-(4-methoxyphenyl)propanamide?
N-cyclohexyl-3-(4-methoxyphenyl)propanamide has a molecular weight of 261.37 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 4590252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).