7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide

C18H16ClN3O2 — CID 43860417

IUPAC7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide
SMILESCCn1cc(C(=O)Nc2ccccn2)c(=O)c2ccc(Cl)c(C)c21
InChIInChI=1S/C18H16ClN3O2/c1-3-22-10-13(18(24)21-15-6-4-5-9-20-15)17(23)12-7-8-14(19)11(2)16(12)22/h4-10H,3H2,1-2H3,(H,20,21,24)
InChIKeyPWONUEGLMRXJKB-UHFFFAOYSA-N
MW341.80 g/mol
LogP3.63
Rot. Bonds3

About 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide

7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide (PubChem CID 43860417) has the molecular formula C18H16ClN3O2 and a molecular weight of 341.80 g/mol. Its IUPAC name is 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide.

Molecular Properties

Compound Name7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide
PubChem CID43860417
Molecular FormulaC18H16ClN3O2
Molecular Weight341.80 g/mol
Exact Mass341.09
IUPAC Name7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide
SMILESCCn1cc(C(=O)Nc2ccccn2)c(=O)c2ccc(Cl)c(C)c21
InChIInChI=1S/C18H16ClN3O2/c1-3-22-10-13(18(24)21-15-6-4-5-9-20-15)17(23)12-7-8-14(19)11(2)16(12)22/h4-10H,3H2,1-2H3,(H,20,21,24)
InChIKeyPWONUEGLMRXJKB-UHFFFAOYSA-N
XLogP3.63
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.80
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-chloro-N-(2-chlorophenyl)-1-ethyl-8-methyl-4-oxoquinoline-3-carboxamide
CID 43860427
7-chloro-1-ethyl-N-(2-fluorophenyl)-8-methyl-4-oxoquinoline-3-carboxamide
CID 43860436
7-chloro-N-(6-chloroquinolin-4-yl)-1-ethyl-8-methyl-4-oxoquinoline-3-carboxamide
CID 43860477
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-7-chloro-1-ethyl-8-methyl-4-oxoquinoline-3-carboxamide
CID 43860466
7-chloro-N-(6-chloro-1,3-benzothiazol-2-yl)-1-ethyl-8-methyl-4-oxoquinoline-3-carboxamide
CID 43860462
7-chloro-1-ethyl-N-(6-fluoro-2-methylquinolin-4-yl)-8-methyl-4-oxoquinoline-3-carboxamide
CID 43860486
1-[(4-chlorophenyl)methyl]-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide
CID 118055361
5-bromo-2-chloro-N-pyridin-2-ylbenzamide
CID 774435
N-(3-chloro-2-methylphenyl)-7-methyl-4-oxo-1-propyl-1,8-naphthyridine-3-carboxamide
CID 53087125
1-methyl-3-N,4-N-dipyridin-2-ylpyrazole-3,4-dicarboxamide
CID 29097607
N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide
CID 121083019
6-chloro-1-ethyl-4-oxo-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide
CID 30132214

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide?
The IUPAC name of 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide (CID 43860417) is 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide.
What is the SMILES notation for 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide?
The canonical SMILES for 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide is CCn1cc(C(=O)Nc2ccccn2)c(=O)c2ccc(Cl)c(C)c21.
What is the InChIKey of 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide?
The InChIKey is PWONUEGLMRXJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN3O2/c1-3-22-10-13(18(24)21-15-6-4-5-9-20-15)17(23)12-7-8-14(19)11(2)16(12)22/h4-10H,3H2,1-2H3,(H,20,21,24).
What are the key properties of 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide?
7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide has a molecular weight of 341.80 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-ethyl-8-methyl-4-oxo-N-pyridin-2-ylquinoline-3-carboxamide is sourced from PubChem (CID 43860417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).