6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide

C19H16ClN3O — CID 6603999

IUPAC6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide
SMILESCc1cc2c(cc1Cl)N(C(=O)Nc1ccnc3ccccc13)CC2
InChIInChI=1S/C19H16ClN3O/c1-12-10-13-7-9-23(18(13)11-15(12)20)19(24)22-17-6-8-21-16-5-3-2-4-14(16)17/h2-6,8,10-11H,7,9H2,1H3,(H,21,22,24)
InChIKeyBPVGSWDWIRIUME-UHFFFAOYSA-N
MW337.81 g/mol
LogP4.79
Rot. Bonds1

About 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide

6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide (PubChem CID 6603999) has the molecular formula C19H16ClN3O and a molecular weight of 337.81 g/mol. Its IUPAC name is 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound Name6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide
PubChem CID6603999
Molecular FormulaC19H16ClN3O
Molecular Weight337.81 g/mol
Exact Mass337.10
IUPAC Name6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide
SMILESCc1cc2c(cc1Cl)N(C(=O)Nc1ccnc3ccccc13)CC2
InChIInChI=1S/C19H16ClN3O/c1-12-10-13-7-9-23(18(13)11-15(12)20)19(24)22-17-6-8-21-16-5-3-2-4-14(16)17/h2-6,8,10-11H,7,9H2,1H3,(H,21,22,24)
InChIKeyBPVGSWDWIRIUME-UHFFFAOYSA-N
XLogP4.79
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.81
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide?
The IUPAC name of 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide (CID 6603999) is 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide is Cc1cc2c(cc1Cl)N(C(=O)Nc1ccnc3ccccc13)CC2.
What is the InChIKey of 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide?
The InChIKey is BPVGSWDWIRIUME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O/c1-12-10-13-7-9-23(18(13)11-15(12)20)19(24)22-17-6-8-21-16-5-3-2-4-14(16)17/h2-6,8,10-11H,7,9H2,1H3,(H,21,22,24).
What are the key properties of 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide?
6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide has a molecular weight of 337.81 g/mol, XLogP of 4.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-methyl-N-quinolin-4-yl-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 6603999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).