N-(1-methylpiperidin-4-yl)-4-phenylbutanamide

C16H24N2O — CID 2971184

IUPACN-(1-methylpiperidin-4-yl)-4-phenylbutanamide
SMILESCN1CCC(NC(=O)CCCc2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-18-12-10-15(11-13-18)17-16(19)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,15H,5,8-13H2,1H3,(H,17,19)
InChIKeyRWFQCZLCIZMOQT-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.22
Rot. Bonds5

About N-(1-methylpiperidin-4-yl)-4-phenylbutanamide

N-(1-methylpiperidin-4-yl)-4-phenylbutanamide (PubChem CID 2971184) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(1-methylpiperidin-4-yl)-4-phenylbutanamide.

Molecular Properties

Compound NameN-(1-methylpiperidin-4-yl)-4-phenylbutanamide
PubChem CID2971184
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(1-methylpiperidin-4-yl)-4-phenylbutanamide
SMILESCN1CCC(NC(=O)CCCc2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-18-12-10-15(11-13-18)17-16(19)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,15H,5,8-13H2,1H3,(H,17,19)
InChIKeyRWFQCZLCIZMOQT-UHFFFAOYSA-N
XLogP2.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-ethylpiperidin-4-yl)-4-phenylbutanamide
CID 17250229
N-(4-hydroxy-4-methylcyclohexyl)-4-phenylbutanamide
CID 75482244
N-[(3R)-1-benzylpyrrolidin-3-yl]-4-phenylbutanamide
CID 51947538
1-(1-methylpiperidin-4-yl)-3-(2-phenylethyl)urea
CID 11499904
N-(1-methylpiperidin-4-yl)-2-(4-phenylphenyl)acetamide
CID 31098228
(2S)-2-amino-N-(1-methylpiperidin-4-yl)-4-phenylbutanamide
CID 104983890
N-(3,3-dimethylcyclopentyl)-4-phenylbutanamide
CID 115880624
N-(1-methylpiperidin-4-yl)-3-oxo-3-phenylpropanamide
CID 110463372
4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide
CID 90597351
N-(azepan-4-yl)-4-phenylbutanamide
CID 105059135
N-(1-ethylsulfonylpiperidin-4-yl)-3-phenylpropanamide
CID 33220250
6-phenyl-N-piperidin-4-ylhexanamide
CID 154665785

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidin-4-yl)-4-phenylbutanamide?
The IUPAC name of N-(1-methylpiperidin-4-yl)-4-phenylbutanamide (CID 2971184) is N-(1-methylpiperidin-4-yl)-4-phenylbutanamide.
What is the SMILES notation for N-(1-methylpiperidin-4-yl)-4-phenylbutanamide?
The canonical SMILES for N-(1-methylpiperidin-4-yl)-4-phenylbutanamide is CN1CCC(NC(=O)CCCc2ccccc2)CC1.
What is the InChIKey of N-(1-methylpiperidin-4-yl)-4-phenylbutanamide?
The InChIKey is RWFQCZLCIZMOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-18-12-10-15(11-13-18)17-16(19)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,15H,5,8-13H2,1H3,(H,17,19).
What are the key properties of N-(1-methylpiperidin-4-yl)-4-phenylbutanamide?
N-(1-methylpiperidin-4-yl)-4-phenylbutanamide has a molecular weight of 260.38 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidin-4-yl)-4-phenylbutanamide is sourced from PubChem (CID 2971184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).