N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide

C18H17N3O2 — CID 110662758

IUPACN-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide
SMILESCc1ccc2cc(CCNC(=O)c3ccccn3)c(=O)[nH]c2c1
InChIInChI=1S/C18H17N3O2/c1-12-5-6-13-11-14(17(22)21-16(13)10-12)7-9-20-18(23)15-4-2-3-8-19-15/h2-6,8,10-11H,7,9H2,1H3,(H,20,23)(H,21,22)
InChIKeyHXERERLFEZYPMJ-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.20
Rot. Bonds4

About N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide

N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide (PubChem CID 110662758) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide
PubChem CID110662758
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide
SMILESCc1ccc2cc(CCNC(=O)c3ccccn3)c(=O)[nH]c2c1
InChIInChI=1S/C18H17N3O2/c1-12-5-6-13-11-14(17(22)21-16(13)10-12)7-9-20-18(23)15-4-2-3-8-19-15/h2-6,8,10-11H,7,9H2,1H3,(H,20,23)(H,21,22)
InChIKeyHXERERLFEZYPMJ-UHFFFAOYSA-N
XLogP2.20
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide (CID 110662758) is N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide is Cc1ccc2cc(CCNC(=O)c3ccccn3)c(=O)[nH]c2c1.
What is the InChIKey of N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is HXERERLFEZYPMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-12-5-6-13-11-14(17(22)21-16(13)10-12)7-9-20-18(23)15-4-2-3-8-19-15/h2-6,8,10-11H,7,9H2,1H3,(H,20,23)(H,21,22).
What are the key properties of N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide?
N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 110662758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).