3-(3-piperidin-2-ylpropanoylamino)benzamide

C15H21N3O2 — CID 62211801

IUPAC3-(3-piperidin-2-ylpropanoylamino)benzamide
SMILESNC(=O)c1cccc(NC(=O)CCC2CCCCN2)c1
InChIInChI=1S/C15H21N3O2/c16-15(20)11-4-3-6-13(10-11)18-14(19)8-7-12-5-1-2-9-17-12/h3-4,6,10,12,17H,1-2,5,7-9H2,(H2,16,20)(H,18,19)
InChIKeyATZUZQYVZNMHDY-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.65
Rot. Bonds5

About 3-(3-piperidin-2-ylpropanoylamino)benzamide

3-(3-piperidin-2-ylpropanoylamino)benzamide (PubChem CID 62211801) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 3-(3-piperidin-2-ylpropanoylamino)benzamide.

Molecular Properties

Compound Name3-(3-piperidin-2-ylpropanoylamino)benzamide
PubChem CID62211801
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name3-(3-piperidin-2-ylpropanoylamino)benzamide
SMILESNC(=O)c1cccc(NC(=O)CCC2CCCCN2)c1
InChIInChI=1S/C15H21N3O2/c16-15(20)11-4-3-6-13(10-11)18-14(19)8-7-12-5-1-2-9-17-12/h3-4,6,10,12,17H,1-2,5,7-9H2,(H2,16,20)(H,18,19)
InChIKeyATZUZQYVZNMHDY-UHFFFAOYSA-N
XLogP1.65
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-3-piperidin-2-ylpropanamide
CID 62210606
N-(3-chlorophenyl)-3-piperidin-2-ylpropanamide
CID 62212060
2-(3-piperidin-2-ylpropanoylamino)benzamide
CID 62210500
N-(3-chloro-4-hydroxyphenyl)-3-piperidin-2-ylpropanamide
CID 107679893
N-(3-fluoro-4-methylphenyl)-3-piperidin-2-ylpropanamide
CID 62212237
N-(2,6-dibromophenyl)-3-piperidin-2-ylpropanamide
CID 107599604
3-piperidin-2-yl-N-(3,4,5-trifluorophenyl)propanamide
CID 62813870
3-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzene-1,3-dicarboxamide
CID 104955014
N-(4-methylsulfanylphenyl)-3-piperidin-2-ylpropanamide
CID 62211364
N-(3-bromophenyl)-2-(2-piperidin-2-ylethoxy)acetamide
CID 62343376
N-(3-acetamidophenyl)-2-piperidin-2-ylacetamide
CID 43151365
N-[3-(carbamoylamino)phenyl]-2-pyrrolidin-2-ylacetamide
CID 61364636

Frequently Asked Questions

What is the IUPAC name of 3-(3-piperidin-2-ylpropanoylamino)benzamide?
The IUPAC name of 3-(3-piperidin-2-ylpropanoylamino)benzamide (CID 62211801) is 3-(3-piperidin-2-ylpropanoylamino)benzamide.
What is the SMILES notation for 3-(3-piperidin-2-ylpropanoylamino)benzamide?
The canonical SMILES for 3-(3-piperidin-2-ylpropanoylamino)benzamide is NC(=O)c1cccc(NC(=O)CCC2CCCCN2)c1.
What is the InChIKey of 3-(3-piperidin-2-ylpropanoylamino)benzamide?
The InChIKey is ATZUZQYVZNMHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c16-15(20)11-4-3-6-13(10-11)18-14(19)8-7-12-5-1-2-9-17-12/h3-4,6,10,12,17H,1-2,5,7-9H2,(H2,16,20)(H,18,19).
What are the key properties of 3-(3-piperidin-2-ylpropanoylamino)benzamide?
3-(3-piperidin-2-ylpropanoylamino)benzamide has a molecular weight of 275.35 g/mol, XLogP of 1.65, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-piperidin-2-ylpropanoylamino)benzamide is sourced from PubChem (CID 62211801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).