N-cyclohexyl-4-(4-methoxyphenyl)butanamide

C17H25NO2 — CID 888773

IUPACN-cyclohexyl-4-(4-methoxyphenyl)butanamide
SMILESCOc1ccc(CCCC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C17H25NO2/c1-20-16-12-10-14(11-13-16)6-5-9-17(19)18-15-7-3-2-4-8-15/h10-13,15H,2-9H2,1H3,(H,18,19)
InChIKeyCWBLTXRMPSNFEO-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.47
Rot. Bonds6

About N-cyclohexyl-4-(4-methoxyphenyl)butanamide

N-cyclohexyl-4-(4-methoxyphenyl)butanamide (PubChem CID 888773) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-cyclohexyl-4-(4-methoxyphenyl)butanamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(4-methoxyphenyl)butanamide
PubChem CID888773
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-cyclohexyl-4-(4-methoxyphenyl)butanamide
SMILESCOc1ccc(CCCC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C17H25NO2/c1-20-16-12-10-14(11-13-16)6-5-9-17(19)18-15-7-3-2-4-8-15/h10-13,15H,2-9H2,1H3,(H,18,19)
InChIKeyCWBLTXRMPSNFEO-UHFFFAOYSA-N
XLogP3.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(4-methoxyphenyl)butanamide?
The IUPAC name of N-cyclohexyl-4-(4-methoxyphenyl)butanamide (CID 888773) is N-cyclohexyl-4-(4-methoxyphenyl)butanamide.
What is the SMILES notation for N-cyclohexyl-4-(4-methoxyphenyl)butanamide?
The canonical SMILES for N-cyclohexyl-4-(4-methoxyphenyl)butanamide is COc1ccc(CCCC(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-4-(4-methoxyphenyl)butanamide?
The InChIKey is CWBLTXRMPSNFEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-20-16-12-10-14(11-13-16)6-5-9-17(19)18-15-7-3-2-4-8-15/h10-13,15H,2-9H2,1H3,(H,18,19).
What are the key properties of N-cyclohexyl-4-(4-methoxyphenyl)butanamide?
N-cyclohexyl-4-(4-methoxyphenyl)butanamide has a molecular weight of 275.39 g/mol, XLogP of 3.47, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(4-methoxyphenyl)butanamide is sourced from PubChem (CID 888773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).