5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide

C11H12ClNO — CID 162379664

IUPAC5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide
SMILESCc1cc2c(cc1Cl)CC(C(N)=O)C2
InChIInChI=1S/C11H12ClNO/c1-6-2-7-3-9(11(13)14)4-8(7)5-10(6)12/h2,5,9H,3-4H2,1H3,(H2,13,14)
InChIKeyYHYLKAUXBJKBIA-UHFFFAOYSA-N
MW209.68 g/mol
LogP1.85
Rot. Bonds1

About 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide

5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 162379664) has the molecular formula C11H12ClNO and a molecular weight of 209.68 g/mol. Its IUPAC name is 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID162379664
Molecular FormulaC11H12ClNO
Molecular Weight209.68 g/mol
Exact Mass209.06
IUPAC Name5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide
SMILESCc1cc2c(cc1Cl)CC(C(N)=O)C2
InChIInChI=1S/C11H12ClNO/c1-6-2-7-3-9(11(13)14)4-8(7)5-10(6)12/h2,5,9H,3-4H2,1H3,(H2,13,14)
InChIKeyYHYLKAUXBJKBIA-UHFFFAOYSA-N
XLogP1.85
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.68
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-chloro-6-methyl-1,3-dihydroisoindole-2-carboxylic acid
CID 141148713
5-bromo-2,3-dihydro-1H-indene-2-carboxamide
CID 77491392
5-chloro-6-methyl-2,3-dihydro-1-benzofuran-2-carboxylic acid
CID 165462903
5-chloro-2,4-dimethylbenzamide
CID 82551019
1-(3-chloro-4-methylphenyl)pyrrolidine-3-carboxamide
CID 117008174
1-(4,5-dichloro-2-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 168696708
5,6-dimethyl-2,3-dihydro-1H-inden-2-ol
CID 86145079
6-chloro-1-deuterio-7-methyl-2,3,4,9-tetrahydrofluorene-1-carboxamide
CID 159669319
methyl 5-chloro-6-methyl-2,3-dihydro-1-benzofuran-2-carboxylate
CID 165466089
5-chloro-6-methyl-2,3-dihydro-1H-isoindole;ethane
CID 156822930
(2,5-dichloro-4-methylphenyl) carbamate
CID 175535955
1,5-dichloro-2,4-dimethylbenzene
CID 4174838

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide (CID 162379664) is 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide is Cc1cc2c(cc1Cl)CC(C(N)=O)C2.
What is the InChIKey of 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is YHYLKAUXBJKBIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClNO/c1-6-2-7-3-9(11(13)14)4-8(7)5-10(6)12/h2,5,9H,3-4H2,1H3,(H2,13,14).
What are the key properties of 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide?
5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 209.68 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-methyl-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 162379664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).