5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide

C18H14ClN3O2 — CID 10125909

IUPAC5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide
SMILESO=C(NC1Cc2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1
InChIInChI=1S/C18H14ClN3O2/c19-12-5-6-14-11(7-12)9-15(20-14)17(23)22-16-8-10-3-1-2-4-13(10)21-18(16)24/h1-7,9,16,20H,8H2,(H,21,24)(H,22,23)
InChIKeyULRSAQLSHVWRKZ-UHFFFAOYSA-N
MW339.78 g/mol
LogP3.11
Rot. Bonds2

About 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide

5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide (PubChem CID 10125909) has the molecular formula C18H14ClN3O2 and a molecular weight of 339.78 g/mol. Its IUPAC name is 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide
PubChem CID10125909
Molecular FormulaC18H14ClN3O2
Molecular Weight339.78 g/mol
Exact Mass339.08
IUPAC Name5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide
SMILESO=C(NC1Cc2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1
InChIInChI=1S/C18H14ClN3O2/c19-12-5-6-14-11(7-12)9-15(20-14)17(23)22-16-8-10-3-1-2-4-13(10)21-18(16)24/h1-7,9,16,20H,8H2,(H,21,24)(H,22,23)
InChIKeyULRSAQLSHVWRKZ-UHFFFAOYSA-N
XLogP3.11
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.78
LogP ≤ 53.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide (CID 10125909) is 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide is O=C(NC1Cc2ccccc2NC1=O)c1cc2cc(Cl)ccc2[nH]1.
What is the InChIKey of 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide?
The InChIKey is ULRSAQLSHVWRKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN3O2/c19-12-5-6-14-11(7-12)9-15(20-14)17(23)22-16-8-10-3-1-2-4-13(10)21-18(16)24/h1-7,9,16,20H,8H2,(H,21,24)(H,22,23).
What are the key properties of 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide?
5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide has a molecular weight of 339.78 g/mol, XLogP of 3.11, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-1H-indole-2-carboxamide is sourced from PubChem (CID 10125909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).