5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide

C11H14ClN3O — CID 62409249

IUPAC5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)NC2CC2C)cc1Cl
InChIInChI=1S/C11H14ClN3O/c1-6-3-9(6)15-11(16)7-4-8(12)10(13-2)14-5-7/h4-6,9H,3H2,1-2H3,(H,13,14)(H,15,16)
InChIKeyRENPBSJHFBAELA-UHFFFAOYSA-N
MW239.71 g/mol
LogP1.91
Rot. Bonds3

About 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide

5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide (PubChem CID 62409249) has the molecular formula C11H14ClN3O and a molecular weight of 239.71 g/mol. Its IUPAC name is 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide
PubChem CID62409249
Molecular FormulaC11H14ClN3O
Molecular Weight239.71 g/mol
Exact Mass239.08
IUPAC Name5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)NC2CC2C)cc1Cl
InChIInChI=1S/C11H14ClN3O/c1-6-3-9(6)15-11(16)7-4-8(12)10(13-2)14-5-7/h4-6,9H,3H2,1-2H3,(H,13,14)(H,15,16)
InChIKeyRENPBSJHFBAELA-UHFFFAOYSA-N
XLogP1.91
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.71
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide (CID 62409249) is 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide is CNc1ncc(C(=O)NC2CC2C)cc1Cl.
What is the InChIKey of 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide?
The InChIKey is RENPBSJHFBAELA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O/c1-6-3-9(6)15-11(16)7-4-8(12)10(13-2)14-5-7/h4-6,9H,3H2,1-2H3,(H,13,14)(H,15,16).
What are the key properties of 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide?
5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide has a molecular weight of 239.71 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide is sourced from PubChem (CID 62409249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).