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

C14H15N3O — CID 60895367

IUPAC4-amino-N-(2-pyridin-3-ylethyl)benzamide
SMILESNc1ccc(C(=O)NCCc2cccnc2)cc1
InChIInChI=1S/C14H15N3O/c15-13-5-3-12(4-6-13)14(18)17-9-7-11-2-1-8-16-10-11/h1-6,8,10H,7,9,15H2,(H,17,18)
InChIKeyXZFNQLODLLXGAI-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.64
Rot. Bonds4

About 4-amino-N-(2-pyridin-3-ylethyl)benzamide

4-amino-N-(2-pyridin-3-ylethyl)benzamide (PubChem CID 60895367) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-amino-N-(2-pyridin-3-ylethyl)benzamide.

Molecular Properties

Compound Name4-amino-N-(2-pyridin-3-ylethyl)benzamide
PubChem CID60895367
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name4-amino-N-(2-pyridin-3-ylethyl)benzamide
SMILESNc1ccc(C(=O)NCCc2cccnc2)cc1
InChIInChI=1S/C14H15N3O/c15-13-5-3-12(4-6-13)14(18)17-9-7-11-2-1-8-16-10-11/h1-6,8,10H,7,9,15H2,(H,17,18)
InChIKeyXZFNQLODLLXGAI-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'}

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Related Compounds

N-[2-[(4-aminobenzoyl)amino]ethyl]pyridine-3-carboxamide
CID 108924536
4-amino-3,5-difluoro-N-(2-pyridin-3-ylethyl)benzamide
CID 63185192
5-amino-2-methyl-N-(2-pyridin-3-ylethyl)benzamide
CID 61290785
4-amino-N-[2-(4-aminophenyl)ethyl]benzamide
CID 110483115
3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide
CID 60895534
N-(2-pyridin-3-ylethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 24661254
N-(2-pyridin-3-ylethyl)-4-(trifluoromethoxy)benzamide
CID 39559682
4-amino-3-methoxy-N-(2-pyridin-3-ylethyl)benzamide
CID 104782485
2-amino-6-chloro-N-(2-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 55041746
2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 62072665
2-(aminomethyl)-N-(2-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 112530316
4-bromo-3-methyl-N-(2-pyridin-3-ylethyl)benzamide
CID 67386076

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-pyridin-3-ylethyl)benzamide?
The IUPAC name of 4-amino-N-(2-pyridin-3-ylethyl)benzamide (CID 60895367) is 4-amino-N-(2-pyridin-3-ylethyl)benzamide.
What is the SMILES notation for 4-amino-N-(2-pyridin-3-ylethyl)benzamide?
The canonical SMILES for 4-amino-N-(2-pyridin-3-ylethyl)benzamide is Nc1ccc(C(=O)NCCc2cccnc2)cc1.
What is the InChIKey of 4-amino-N-(2-pyridin-3-ylethyl)benzamide?
The InChIKey is XZFNQLODLLXGAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c15-13-5-3-12(4-6-13)14(18)17-9-7-11-2-1-8-16-10-11/h1-6,8,10H,7,9,15H2,(H,17,18).
What are the key properties of 4-amino-N-(2-pyridin-3-ylethyl)benzamide?
4-amino-N-(2-pyridin-3-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 4-amino-N-(2-pyridin-3-ylethyl)benzamide is sourced from PubChem (CID 60895367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).