4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide

C18H17N3O2 — CID 136545220

IUPAC4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide
SMILESCc1ccncc1C(=O)NCc1cc2ccccc2n(C)c1=O
InChIInChI=1S/C18H17N3O2/c1-12-7-8-19-11-15(12)17(22)20-10-14-9-13-5-3-4-6-16(13)21(2)18(14)23/h3-9,11H,10H2,1-2H3,(H,20,22)
InChIKeyZMPZELUSEWMXLH-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.17
Rot. Bonds3

About 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide

4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide (PubChem CID 136545220) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide
PubChem CID136545220
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide
SMILESCc1ccncc1C(=O)NCc1cc2ccccc2n(C)c1=O
InChIInChI=1S/C18H17N3O2/c1-12-7-8-19-11-15(12)17(22)20-10-14-9-13-5-3-4-6-16(13)21(2)18(14)23/h3-9,11H,10H2,1-2H3,(H,20,22)
InChIKeyZMPZELUSEWMXLH-UHFFFAOYSA-N
XLogP2.17
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide (CID 136545220) is 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide is Cc1ccncc1C(=O)NCc1cc2ccccc2n(C)c1=O.
What is the InChIKey of 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide?
The InChIKey is ZMPZELUSEWMXLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-12-7-8-19-11-15(12)17(22)20-10-14-9-13-5-3-4-6-16(13)21(2)18(14)23/h3-9,11H,10H2,1-2H3,(H,20,22).
What are the key properties of 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide?
4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(1-methyl-2-oxoquinolin-3-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 136545220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).