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

C15H17N3O — CID 60895534

IUPAC3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide
SMILESNCc1cccc(C(=O)NCCc2cccnc2)c1
InChIInChI=1S/C15H17N3O/c16-10-13-3-1-5-14(9-13)15(19)18-8-6-12-4-2-7-17-11-12/h1-5,7,9,11H,6,8,10,16H2,(H,18,19)
InChIKeyMHWLDQANIDVGOW-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.51
Rot. Bonds5

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

3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide (PubChem CID 60895534) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide.

Molecular Properties

Compound Name3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide
PubChem CID60895534
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide
SMILESNCc1cccc(C(=O)NCCc2cccnc2)c1
InChIInChI=1S/C15H17N3O/c16-10-13-3-1-5-14(9-13)15(19)18-8-6-12-4-2-7-17-11-12/h1-5,7,9,11H,6,8,10,16H2,(H,18,19)
InChIKeyMHWLDQANIDVGOW-UHFFFAOYSA-N
XLogP1.51
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-(2-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 112530316
4-amino-N-(2-pyridin-3-ylethyl)benzamide
CID 60895367
N-(2-pyridin-3-ylethyl)-1,3-benzothiazole-6-carboxamide
CID 31398756
4-amino-3,5-difluoro-N-(2-pyridin-3-ylethyl)benzamide
CID 63185192
2-bromo-N-(2-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 103752224
3-(aminomethyl)-N-[2-(1H-pyrrol-3-yl)ethyl]benzamide
CID 115161194
4-bromo-3-methyl-N-(2-pyridin-3-ylethyl)benzamide
CID 67386076
N-(2-pyridin-3-ylethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 24661254
4-amino-3-methoxy-N-(2-pyridin-3-ylethyl)benzamide
CID 104782485
N-(4-pyridin-3-ylbutyl)pyridine-3-carboxamide
CID 110661295
4-(aminomethyl)-N-(pyridin-3-ylmethyl)benzamide
CID 28545926
3-methyl-4-(methylamino)-N-(2-pyridin-3-ylethyl)benzamide
CID 63210322

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide?
The IUPAC name of 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide (CID 60895534) is 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide.
What is the SMILES notation for 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide?
The canonical SMILES for 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide is NCc1cccc(C(=O)NCCc2cccnc2)c1.
What is the InChIKey of 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide?
The InChIKey is MHWLDQANIDVGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c16-10-13-3-1-5-14(9-13)15(19)18-8-6-12-4-2-7-17-11-12/h1-5,7,9,11H,6,8,10,16H2,(H,18,19).
What are the key properties of 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide?
3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide has a molecular weight of 255.32 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide is sourced from PubChem (CID 60895534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).