5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide

C15H17ClN4O — CID 114924077

IUPAC5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2ccc(C)nc2C)c(Cl)cn1
InChIInChI=1S/C15H17ClN4O/c1-4-17-14-7-11(12(16)8-18-14)15(21)20-13-6-5-9(2)19-10(13)3/h5-8H,4H2,1-3H3,(H,17,18)(H,20,21)
InChIKeyDIQMCQIPGFNHQR-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.43
Rot. Bonds4

About 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide

5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide (PubChem CID 114924077) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide
PubChem CID114924077
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2ccc(C)nc2C)c(Cl)cn1
InChIInChI=1S/C15H17ClN4O/c1-4-17-14-7-11(12(16)8-18-14)15(21)20-13-6-5-9(2)19-10(13)3/h5-8H,4H2,1-3H3,(H,17,18)(H,20,21)
InChIKeyDIQMCQIPGFNHQR-UHFFFAOYSA-N
XLogP3.43
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(2-chloro-4-fluorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 114922085
5-chloro-N-(2,4-dibromophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 114923151
5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(ethylamino)pyridine-4-carboxamide
CID 114923155
5-chloro-2-(ethylamino)-N-(5-fluoro-2-pyridinyl)pyridine-4-carboxamide
CID 114923893
2-chloro-N-(2,6-dimethyl-3-pyridinyl)-5-hydroxybenzamide
CID 106501987
N-(2,6-dimethyl-3-pyridinyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81245038
5-chloro-2-(ethylamino)-N-(3-ethylpentan-3-yl)pyridine-4-carboxamide
CID 114923855
5-chloro-2-(ethylamino)-N-(2-methyl-2-methylsulfanylpropyl)pyridine-4-carboxamide
CID 114924529
5-chloro-N-(5-methyl-2-pyridinyl)-2-(propylamino)pyridine-4-carboxamide
CID 114921617
5-chloro-2-(methylamino)-N-(2-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 114923981
5-chloro-N-cyclohexyl-2-(ethylamino)pyridine-4-carboxamide
CID 114921677
5-chloro-N-(2,3-dimethylbutyl)-2-(ethylamino)pyridine-4-carboxamide
CID 114923804

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide?
The IUPAC name of 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide (CID 114924077) is 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide.
What is the SMILES notation for 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide?
The canonical SMILES for 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide is CCNc1cc(C(=O)Nc2ccc(C)nc2C)c(Cl)cn1.
What is the InChIKey of 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide?
The InChIKey is DIQMCQIPGFNHQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-4-17-14-7-11(12(16)8-18-14)15(21)20-13-6-5-9(2)19-10(13)3/h5-8H,4H2,1-3H3,(H,17,18)(H,20,21).
What are the key properties of 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide?
5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 3.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,6-dimethyl-3-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 114924077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).