N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide

C17H25N3O2 — CID 119671646

IUPACN-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide
SMILESCC(=O)Nc1cccc(NC(=O)CC(C)C2CCNCC2)c1
InChIInChI=1S/C17H25N3O2/c1-12(14-6-8-18-9-7-14)10-17(22)20-16-5-3-4-15(11-16)19-13(2)21/h3-5,11-12,14,18H,6-10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyAJSZWYNQONNKMS-UHFFFAOYSA-N
MW303.41 g/mol
LogP2.61
Rot. Bonds5

About N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide

N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide (PubChem CID 119671646) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide
PubChem CID119671646
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameN-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide
SMILESCC(=O)Nc1cccc(NC(=O)CC(C)C2CCNCC2)c1
InChIInChI=1S/C17H25N3O2/c1-12(14-6-8-18-9-7-14)10-17(22)20-16-5-3-4-15(11-16)19-13(2)21/h3-5,11-12,14,18H,6-10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyAJSZWYNQONNKMS-UHFFFAOYSA-N
XLogP2.61
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(phenylcarbamoylamino)phenyl]-3-piperidin-4-ylbutanamide
CID 119700701
N-(3-chlorophenyl)-3-piperidin-4-ylbutanamide
CID 119671037
N-[3-(3-piperidin-4-ylbutanoylamino)phenyl]cyclohexanecarboxamide
CID 119814649
N-(3-acetamidophenyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119671636
N-[3-[methyl(propan-2-yl)amino]phenyl]-3-piperidin-4-ylbutanamide
CID 119883178
N-(3-cyclopentyloxyphenyl)-3-piperidin-4-ylbutanamide
CID 119714969
N-(3-fluorophenyl)-3-(3-piperidin-4-ylbutanoylamino)benzamide
CID 119740430
3-piperidin-4-yl-N-pyridin-4-ylbutanamide
CID 119827125
N-[2-(3-acetamidophenoxy)ethyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119776231
N-[2-(3-fluoroanilino)-2-oxoethyl]-3-piperidin-4-ylbutanamide
CID 119758092
3-piperidin-4-yl-N-[3-(thiomorpholin-4-ylmethyl)phenyl]butanamide
CID 119869797
N-(1,3-benzodioxol-5-yl)-3-piperidin-4-ylbutanamide
CID 119668964

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide?
The IUPAC name of N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide (CID 119671646) is N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide.
What is the SMILES notation for N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide?
The canonical SMILES for N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide is CC(=O)Nc1cccc(NC(=O)CC(C)C2CCNCC2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide?
The InChIKey is AJSZWYNQONNKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-12(14-6-8-18-9-7-14)10-17(22)20-16-5-3-4-15(11-16)19-13(2)21/h3-5,11-12,14,18H,6-10H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide?
N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide has a molecular weight of 303.41 g/mol, XLogP of 2.61, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide is sourced from PubChem (CID 119671646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).