2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide

C18H19N3O3 — CID 136541919

IUPAC2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)c2ccnc(NC(=O)C3CC3)c2)c(C)c1
InChIInChI=1S/C18H19N3O3/c1-11-9-14(24-2)5-6-15(11)20-18(23)13-7-8-19-16(10-13)21-17(22)12-3-4-12/h5-10,12H,3-4H2,1-2H3,(H,20,23)(H,19,21,22)
InChIKeySOYVREVHGNRSHZ-UHFFFAOYSA-N
MW325.37 g/mol
LogP3.00
Rot. Bonds5

About 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide

2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide (PubChem CID 136541919) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide
PubChem CID136541919
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)c2ccnc(NC(=O)C3CC3)c2)c(C)c1
InChIInChI=1S/C18H19N3O3/c1-11-9-14(24-2)5-6-15(11)20-18(23)13-7-8-19-16(10-13)21-17(22)12-3-4-12/h5-10,12H,3-4H2,1-2H3,(H,20,23)(H,19,21,22)
InChIKeySOYVREVHGNRSHZ-UHFFFAOYSA-N
XLogP3.00
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide (CID 136541919) is 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide is COc1ccc(NC(=O)c2ccnc(NC(=O)C3CC3)c2)c(C)c1.
What is the InChIKey of 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide?
The InChIKey is SOYVREVHGNRSHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-11-9-14(24-2)5-6-15(11)20-18(23)13-7-8-19-16(10-13)21-17(22)12-3-4-12/h5-10,12H,3-4H2,1-2H3,(H,20,23)(H,19,21,22).
What are the key properties of 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide?
2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide has a molecular weight of 325.37 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropanecarbonylamino)-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 136541919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).