6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide

C16H17N3O — CID 162523863

IUPAC6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide
SMILESCc1ccccc1Nc1nc(C2CC2)ccc1C(N)=O
InChIInChI=1S/C16H17N3O/c1-10-4-2-3-5-13(10)18-16-12(15(17)20)8-9-14(19-16)11-6-7-11/h2-5,8-9,11H,6-7H2,1H3,(H2,17,20)(H,18,19)
InChIKeyRYNRJBSPOBRRFO-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.11
Rot. Bonds4

About 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide

6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide (PubChem CID 162523863) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide
PubChem CID162523863
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide
SMILESCc1ccccc1Nc1nc(C2CC2)ccc1C(N)=O
InChIInChI=1S/C16H17N3O/c1-10-4-2-3-5-13(10)18-16-12(15(17)20)8-9-14(19-16)11-6-7-11/h2-5,8-9,11H,6-7H2,1H3,(H2,17,20)(H,18,19)
InChIKeyRYNRJBSPOBRRFO-UHFFFAOYSA-N
XLogP3.11
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide?
The IUPAC name of 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide (CID 162523863) is 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide.
What is the SMILES notation for 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide?
The canonical SMILES for 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide is Cc1ccccc1Nc1nc(C2CC2)ccc1C(N)=O.
What is the InChIKey of 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide?
The InChIKey is RYNRJBSPOBRRFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-10-4-2-3-5-13(10)18-16-12(15(17)20)8-9-14(19-16)11-6-7-11/h2-5,8-9,11H,6-7H2,1H3,(H2,17,20)(H,18,19).
What are the key properties of 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide?
6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-2-(2-methylanilino)pyridine-3-carboxamide is sourced from PubChem (CID 162523863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).