3-amino-N-(2-pyridin-2-ylethyl)benzamide

C14H15N3O — CID 24704285

IUPAC3-amino-N-(2-pyridin-2-ylethyl)benzamide
SMILESNc1cccc(C(=O)NCCc2ccccn2)c1
InChIInChI=1S/C14H15N3O/c15-12-5-3-4-11(10-12)14(18)17-9-7-13-6-1-2-8-16-13/h1-6,8,10H,7,9,15H2,(H,17,18)
InChIKeyVDKALECLASKSEI-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.64
Rot. Bonds4

About 3-amino-N-(2-pyridin-2-ylethyl)benzamide

3-amino-N-(2-pyridin-2-ylethyl)benzamide (PubChem CID 24704285) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-amino-N-(2-pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-amino-N-(2-pyridin-2-ylethyl)benzamide
PubChem CID24704285
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name3-amino-N-(2-pyridin-2-ylethyl)benzamide
SMILESNc1cccc(C(=O)NCCc2ccccn2)c1
InChIInChI=1S/C14H15N3O/c15-12-5-3-4-11(10-12)14(18)17-9-7-13-6-1-2-8-16-13/h1-6,8,10H,7,9,15H2,(H,17,18)
InChIKeyVDKALECLASKSEI-UHFFFAOYSA-N
XLogP1.64
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 3-amino-N-(2-pyridin-2-ylethyl)benzamide 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-(2-aminoethyl)-N-(2-pyridin-2-ylethyl)benzamide
CID 62592960
2,4-diamino-N-(2-pyridin-2-ylethyl)benzamide
CID 61095096
2-(hydroxymethyl)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 115116136
N-(2-pyridin-2-ylethyl)-1H-indole-6-carboxamide
CID 22139228
5-amino-N-(2-pyridin-2-ylethyl)-1-benzothiophene-2-carboxamide
CID 61095095
N-(2-pyridin-2-ylethyl)-3-[3-(trifluoromethyl)phenoxy]benzamide
CID 46652635
2-amino-6-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 24701596
3-bromo-N-[2-(3-pyridin-2-ylpropanoylamino)ethyl]benzamide
CID 60615561
3-methoxy-N-[2-[[N'-methyl-N-(2-pyridin-2-ylethyl)carbamimidoyl]amino]ethyl]benzamide
CID 111193916
6-amino-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide
CID 62152173
2-chloro-6-hydrazinyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 62236748
3,4-dichloro-N-(3-pyridin-2-ylpropyl)benzamide
CID 110660973

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-pyridin-2-ylethyl)benzamide?
The IUPAC name of 3-amino-N-(2-pyridin-2-ylethyl)benzamide (CID 24704285) is 3-amino-N-(2-pyridin-2-ylethyl)benzamide.
What is the SMILES notation for 3-amino-N-(2-pyridin-2-ylethyl)benzamide?
The canonical SMILES for 3-amino-N-(2-pyridin-2-ylethyl)benzamide is Nc1cccc(C(=O)NCCc2ccccn2)c1.
What is the InChIKey of 3-amino-N-(2-pyridin-2-ylethyl)benzamide?
The InChIKey is VDKALECLASKSEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c15-12-5-3-4-11(10-12)14(18)17-9-7-13-6-1-2-8-16-13/h1-6,8,10H,7,9,15H2,(H,17,18).
What are the key properties of 3-amino-N-(2-pyridin-2-ylethyl)benzamide?
3-amino-N-(2-pyridin-2-ylethyl)benzamide has a molecular weight of 241.29 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 24704285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).