2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide

C13H14N4O — CID 62072665

IUPAC2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
SMILESNc1ncccc1C(=O)NCCc1cccnc1
InChIInChI=1S/C13H14N4O/c14-12-11(4-2-7-16-12)13(18)17-8-5-10-3-1-6-15-9-10/h1-4,6-7,9H,5,8H2,(H2,14,16)(H,17,18)
InChIKeyFXQODTBRHGFBOA-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.03
Rot. Bonds4

About 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide

2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide (PubChem CID 62072665) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
PubChem CID62072665
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
SMILESNc1ncccc1C(=O)NCCc1cccnc1
InChIInChI=1S/C13H14N4O/c14-12-11(4-2-7-16-12)13(18)17-8-5-10-3-1-6-15-9-10/h1-4,6-7,9H,5,8H2,(H2,14,16)(H,17,18)
InChIKeyFXQODTBRHGFBOA-UHFFFAOYSA-N
XLogP1.03
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(methylamino)-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 62180569
2-ethoxy-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 39561652
5-amino-2-methyl-N-(2-pyridin-3-ylethyl)benzamide
CID 61290785
4-amino-N-(2-pyridin-3-ylethyl)benzamide
CID 60895367
5-amino-1-methyl-N-(2-pyridin-3-ylethyl)pyrazole-4-carboxamide
CID 115330467
3,6-dichloro-N-(2-pyridin-3-ylethyl)pyridazine-4-carboxamide
CID 114038414
2-anilino-N-(2-pyridin-3-ylethyl)benzamide
CID 36866409
4-amino-3,5-difluoro-N-(2-pyridin-3-ylethyl)benzamide
CID 63185192
2-(difluoromethoxy)-N-(2-pyridin-3-ylethyl)benzamide
CID 39561684
2-amino-N-(3,3-dimethylbutyl)pyridine-3-carboxamide
CID 115597344
2-fluoro-6-hydroxy-N-(2-pyridin-3-ylethyl)benzamide
CID 104916776
2-(2-aminophenyl)-N-(2-pyridin-3-ylethyl)acetamide
CID 60895368

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide (CID 62072665) is 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide is Nc1ncccc1C(=O)NCCc1cccnc1.
What is the InChIKey of 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide?
The InChIKey is FXQODTBRHGFBOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c14-12-11(4-2-7-16-12)13(18)17-8-5-10-3-1-6-15-9-10/h1-4,6-7,9H,5,8H2,(H2,14,16)(H,17,18).
What are the key properties of 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide?
2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 1.03, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 62072665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).