3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide

C16H23N3O2 — CID 110426221

IUPAC3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide
SMILESCC(=O)NCCC(=O)Nc1cccc(N2CCCCC2)c1
InChIInChI=1S/C16H23N3O2/c1-13(20)17-9-8-16(21)18-14-6-5-7-15(12-14)19-10-3-2-4-11-19/h5-7,12H,2-4,8-11H2,1H3,(H,17,20)(H,18,21)
InChIKeyOLXQNLYEPLJCHR-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.14
Rot. Bonds5

About 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide

3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide (PubChem CID 110426221) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide.

Molecular Properties

Compound Name3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide
PubChem CID110426221
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide
SMILESCC(=O)NCCC(=O)Nc1cccc(N2CCCCC2)c1
InChIInChI=1S/C16H23N3O2/c1-13(20)17-9-8-16(21)18-14-6-5-7-15(12-14)19-10-3-2-4-11-19/h5-7,12H,2-4,8-11H2,1H3,(H,17,20)(H,18,21)
InChIKeyOLXQNLYEPLJCHR-UHFFFAOYSA-N
XLogP2.14
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-acetamido-N-[4-(azepan-1-yl)phenyl]propanamide
CID 17462050
N-[3-(azepan-1-yl)phenyl]-4-(methylamino)butanamide;dihydrochloride
CID 119892130
2-chloro-N-(3-piperidin-1-ylphenyl)acetamide
CID 43822445
4-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)butanamide
CID 54862533
4-amino-N-[3-(azepan-1-yl)phenyl]pentanamide
CID 120565751
3-(cyclopropylamino)-N-(3-pyrrolidin-1-ylphenyl)propanamide
CID 60926982
4-(propan-2-ylamino)-N-(3-pyrrolidin-1-ylphenyl)butanamide
CID 60928577
2-amino-N-[3-(azepan-1-yl)phenyl]acetamide
CID 119892163
N-[3-(azepan-1-yl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 120704662
2-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 54862520
7-amino-N-[3-(azepan-1-yl)phenyl]heptanamide
CID 119892117
5-bromo-N-(3-pyrrolidin-1-ylphenyl)pentanamide
CID 114014794

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide?
The IUPAC name of 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide (CID 110426221) is 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide.
What is the SMILES notation for 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide?
The canonical SMILES for 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide is CC(=O)NCCC(=O)Nc1cccc(N2CCCCC2)c1.
What is the InChIKey of 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide?
The InChIKey is OLXQNLYEPLJCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-13(20)17-9-8-16(21)18-14-6-5-7-15(12-14)19-10-3-2-4-11-19/h5-7,12H,2-4,8-11H2,1H3,(H,17,20)(H,18,21).
What are the key properties of 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide?
3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide has a molecular weight of 289.38 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide is sourced from PubChem (CID 110426221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).