3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide

C16H23N3O2 — CID 119377560

IUPAC3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide
SMILESCCCNC(=O)c1cccc(C(=O)N2CCCC(N)C2)c1
InChIInChI=1S/C16H23N3O2/c1-2-8-18-15(20)12-5-3-6-13(10-12)16(21)19-9-4-7-14(17)11-19/h3,5-6,10,14H,2,4,7-9,11,17H2,1H3,(H,18,20)
InChIKeyDYMJJOVVENQOQN-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.39
Rot. Bonds4

About 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide

3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide (PubChem CID 119377560) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide.

Molecular Properties

Compound Name3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide
PubChem CID119377560
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide
SMILESCCCNC(=O)c1cccc(C(=O)N2CCCC(N)C2)c1
InChIInChI=1S/C16H23N3O2/c1-2-8-18-15(20)12-5-3-6-13(10-12)16(21)19-9-4-7-14(17)11-19/h3,5-6,10,14H,2,4,7-9,11,17H2,1H3,(H,18,20)
InChIKeyDYMJJOVVENQOQN-UHFFFAOYSA-N
XLogP1.39
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[3-(aminomethyl)pyrrolidine-1-carbonyl]-N-propylbenzamide;hydrochloride
CID 119483619
3-(4-methylpiperidine-1-carbonyl)-N-propylbenzamide
CID 109050285
methyl 3-(3-aminopiperidine-1-carbonyl)benzoate
CID 176515174
2-[1-[3-(propylcarbamoyl)benzoyl]piperidin-4-yl]acetic acid
CID 119177928
3-(4-acetylpiperazine-1-carbonyl)-N-propylbenzamide
CID 109050297
N-[3-(3-aminopiperidine-1-carbonyl)phenyl]propane-1-sulfonamide
CID 119380877
(3-aminopiperidin-1-yl)-(3-bromophenyl)methanone;hydrochloride
CID 119377080
3-(4-methylpiperazine-1-carbonyl)-N-propylbenzamide
CID 109050294
3-(3-piperazin-1-ylpyrrolidine-1-carbonyl)-N-propylbenzamide
CID 120996709
3-amino-N-propylpiperidine-1-carboxamide
CID 61295715
3-(2-ethylpiperidine-1-carbonyl)-N-propylbenzamide
CID 109050358
1-[3-(propylcarbamoyl)benzoyl]pyrrolidine-2-carboxylic acid
CID 119355514

Frequently Asked Questions

What is the IUPAC name of 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide?
The IUPAC name of 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide (CID 119377560) is 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide.
What is the SMILES notation for 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide?
The canonical SMILES for 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide is CCCNC(=O)c1cccc(C(=O)N2CCCC(N)C2)c1.
What is the InChIKey of 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide?
The InChIKey is DYMJJOVVENQOQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-2-8-18-15(20)12-5-3-6-13(10-12)16(21)19-9-4-7-14(17)11-19/h3,5-6,10,14H,2,4,7-9,11,17H2,1H3,(H,18,20).
What are the key properties of 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide?
3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide has a molecular weight of 289.38 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminopiperidine-1-carbonyl)-N-propylbenzamide is sourced from PubChem (CID 119377560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).