N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide

C13H13ClN4O — CID 104640067

IUPACN-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)Nc2ccc(Cl)cn2)nc1
InChIInChI=1S/C13H13ClN4O/c1-2-15-10-4-5-11(16-8-10)13(19)18-12-6-3-9(14)7-17-12/h3-8,15H,2H2,1H3,(H,17,18,19)
InChIKeyOXVWDSICCLUSMX-UHFFFAOYSA-N
MW276.73 g/mol
LogP2.81
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide

N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide (PubChem CID 104640067) has the molecular formula C13H13ClN4O and a molecular weight of 276.73 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide
PubChem CID104640067
Molecular FormulaC13H13ClN4O
Molecular Weight276.73 g/mol
Exact Mass276.08
IUPAC NameN-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)Nc2ccc(Cl)cn2)nc1
InChIInChI=1S/C13H13ClN4O/c1-2-15-10-4-5-11(16-8-10)13(19)18-12-6-3-9(14)7-17-12/h3-8,15H,2H2,1H3,(H,17,18,19)
InChIKeyOXVWDSICCLUSMX-UHFFFAOYSA-N
XLogP2.81
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.73
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide
CID 104640066
N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide
CID 104641632
N-(5-chloro-2-fluorophenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104640210
N-(5-chloro-2-pyridinyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107374336
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
N-(5-chloro-2-pyridinyl)-4-(ethylamino)-3,5-difluorobenzamide
CID 63187369
N-(5-chloro-2-pyridinyl)-4-(propanoylamino)benzamide
CID 2988082
N-(5-chloro-2-pyridinyl)-5-(ethylamino)-1,3,4-thiadiazole-2-carboxamide
CID 80615093
N-(5-chloro-2-pyridinyl)-2-(ethylamino)-5-methylbenzamide
CID 62508806
5-(butylamino)-N-(4-chlorophenyl)pyridine-2-carboxamide
CID 109180928
5-(ethylamino)-N-(2,4,6-trifluorophenyl)pyridine-2-carboxamide
CID 104641649
N-(3-bromo-4-chlorophenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104641780

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide (CID 104640067) is N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide is CCNc1ccc(C(=O)Nc2ccc(Cl)cn2)nc1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide?
The InChIKey is OXVWDSICCLUSMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN4O/c1-2-15-10-4-5-11(16-8-10)13(19)18-12-6-3-9(14)7-17-12/h3-8,15H,2H2,1H3,(H,17,18,19).
What are the key properties of N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide?
N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide has a molecular weight of 276.73 g/mol, XLogP of 2.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 104640067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).