N-cyclohexyl-N-methyl-4-phenylbutanamide

C17H25NO — CID 68983837

IUPACN-cyclohexyl-N-methyl-4-phenylbutanamide
SMILESCN(C(=O)CCCc1ccccc1)C1CCCCC1
InChIInChI=1S/C17H25NO/c1-18(16-12-6-3-7-13-16)17(19)14-8-11-15-9-4-2-5-10-15/h2,4-5,9-10,16H,3,6-8,11-14H2,1H3
InChIKeyVFHAULUFIAKKEJ-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.80
Rot. Bonds5

About N-cyclohexyl-N-methyl-4-phenylbutanamide

N-cyclohexyl-N-methyl-4-phenylbutanamide (PubChem CID 68983837) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-4-phenylbutanamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-4-phenylbutanamide
PubChem CID68983837
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC NameN-cyclohexyl-N-methyl-4-phenylbutanamide
SMILESCN(C(=O)CCCc1ccccc1)C1CCCCC1
InChIInChI=1S/C17H25NO/c1-18(16-12-6-3-7-13-16)17(19)14-8-11-15-9-4-2-5-10-15/h2,4-5,9-10,16H,3,6-8,11-14H2,1H3
InChIKeyVFHAULUFIAKKEJ-UHFFFAOYSA-N
XLogP3.80
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-4-phenylbutanamide?
The IUPAC name of N-cyclohexyl-N-methyl-4-phenylbutanamide (CID 68983837) is N-cyclohexyl-N-methyl-4-phenylbutanamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-4-phenylbutanamide?
The canonical SMILES for N-cyclohexyl-N-methyl-4-phenylbutanamide is CN(C(=O)CCCc1ccccc1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-4-phenylbutanamide?
The InChIKey is VFHAULUFIAKKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-18(16-12-6-3-7-13-16)17(19)14-8-11-15-9-4-2-5-10-15/h2,4-5,9-10,16H,3,6-8,11-14H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-4-phenylbutanamide?
N-cyclohexyl-N-methyl-4-phenylbutanamide has a molecular weight of 259.39 g/mol, XLogP of 3.80, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-4-phenylbutanamide is sourced from PubChem (CID 68983837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).