5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide

C19H17BrN2O — CID 112526466

IUPAC5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESCc1cc2c(NC(=O)C3Cc4ccc(Br)cc4C3)cccc2[nH]1
InChIInChI=1S/C19H17BrN2O/c1-11-7-16-17(21-11)3-2-4-18(16)22-19(23)14-8-12-5-6-15(20)10-13(12)9-14/h2-7,10,14,21H,8-9H2,1H3,(H,22,23)
InChIKeyRLMATHGRSHQZIU-UHFFFAOYSA-N
MW369.26 g/mol
LogP4.59
Rot. Bonds2

About 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide

5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 112526466) has the molecular formula C19H17BrN2O and a molecular weight of 369.26 g/mol. Its IUPAC name is 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID112526466
Molecular FormulaC19H17BrN2O
Molecular Weight369.26 g/mol
Exact Mass368.05
IUPAC Name5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESCc1cc2c(NC(=O)C3Cc4ccc(Br)cc4C3)cccc2[nH]1
InChIInChI=1S/C19H17BrN2O/c1-11-7-16-17(21-11)3-2-4-18(16)22-19(23)14-8-12-5-6-15(20)10-13(12)9-14/h2-7,10,14,21H,8-9H2,1H3,(H,22,23)
InChIKeyRLMATHGRSHQZIU-UHFFFAOYSA-N
XLogP4.59
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.26
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

5-bromo-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112525315
5-bromo-N-(1H-indazol-3-yl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112527867
5-bromo-N-[3-(dimethylamino)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 84577492
tert-butyl N-(2-methyl-1H-indol-4-yl)carbamate
CID 134485440
5-bromo-N-(4-hydroxyphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 84578206
N-(4-bromo-2-ethylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106703922
4-[(2-methyl-1H-indol-4-yl)amino]pent-3-en-2-one
CID 71834899
5-bromo-N-(2-methylpyrazol-3-yl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112524848
N-(2-bromo-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106737103
5-bromo-N-(2-methyl-1,3-benzothiazol-5-yl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112525640
5-bromo-N-(2-methoxyethyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 84578269
5-bromo-2,3-dihydro-1H-indene-2-carboxamide
CID 77491392

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide (CID 112526466) is 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide is Cc1cc2c(NC(=O)C3Cc4ccc(Br)cc4C3)cccc2[nH]1.
What is the InChIKey of 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is RLMATHGRSHQZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17BrN2O/c1-11-7-16-17(21-11)3-2-4-18(16)22-19(23)14-8-12-5-6-15(20)10-13(12)9-14/h2-7,10,14,21H,8-9H2,1H3,(H,22,23).
What are the key properties of 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide?
5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 369.26 g/mol, XLogP of 4.59, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-methyl-1H-indol-4-yl)-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 112526466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).