3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide

C15H11ClN4O — CID 104741160

IUPAC3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide
SMILESNc1cccnc1C(=O)Nc1cc(Cl)cc2cccnc12
InChIInChI=1S/C15H11ClN4O/c16-10-7-9-3-1-5-18-13(9)12(8-10)20-15(21)14-11(17)4-2-6-19-14/h1-8H,17H2,(H,20,21)
InChIKeySESJJHPIPDEMES-UHFFFAOYSA-N
MW298.73 g/mol
LogP3.12
Rot. Bonds2

About 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide

3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide (PubChem CID 104741160) has the molecular formula C15H11ClN4O and a molecular weight of 298.73 g/mol. Its IUPAC name is 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide
PubChem CID104741160
Molecular FormulaC15H11ClN4O
Molecular Weight298.73 g/mol
Exact Mass298.06
IUPAC Name3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide
SMILESNc1cccnc1C(=O)Nc1cc(Cl)cc2cccnc12
InChIInChI=1S/C15H11ClN4O/c16-10-7-9-3-1-5-18-13(9)12(8-10)20-15(21)14-11(17)4-2-6-19-14/h1-8H,17H2,(H,20,21)
InChIKeySESJJHPIPDEMES-UHFFFAOYSA-N
XLogP3.12
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.73
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(6-chloroquinolin-8-yl)benzamide
CID 43698580
3-amino-N-(2-bromo-5-chlorophenyl)pyridine-2-carboxamide
CID 113447794
2-[(3-aminopyridine-2-carbonyl)amino]-4-chlorobenzoic acid
CID 104741854
3-amino-N-(4-chloro-2-iodophenyl)pyridine-2-carboxamide
CID 107625379
N-(6-chloroquinolin-8-yl)-1,4-dimethylpyrazole-3-carboxamide
CID 166321071
N-(6-chloroquinolin-8-yl)-2-fluorobenzamide
CID 39975947
N-(6-chloroquinolin-8-yl)furan-2-carboxamide
CID 60729929
2-chloro-N-(6-chloroquinolin-8-yl)propanamide
CID 43696479
(6-chloroquinolin-8-yl)hydrazine
CID 138505780
2-(1-aminocyclopentyl)-N-(6-chloroquinolin-8-yl)acetamide
CID 64685201
N-(6-chloroquinolin-8-yl)-5-hydroxypentanamide
CID 79199292
3-amino-N-(3-chloro-2-pyridinyl)pyridine-2-carboxamide
CID 103094260

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide (CID 104741160) is 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide is Nc1cccnc1C(=O)Nc1cc(Cl)cc2cccnc12.
What is the InChIKey of 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide?
The InChIKey is SESJJHPIPDEMES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN4O/c16-10-7-9-3-1-5-18-13(9)12(8-10)20-15(21)14-11(17)4-2-6-19-14/h1-8H,17H2,(H,20,21).
What are the key properties of 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide?
3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide has a molecular weight of 298.73 g/mol, XLogP of 3.12, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide is sourced from PubChem (CID 104741160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).