N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide

C15H13BrN2O — CID 43325607

IUPACN-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESO=C(Nc1ccccc1Br)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H13BrN2O/c16-12-3-1-2-4-14(12)18-15(19)11-5-6-13-10(9-11)7-8-17-13/h1-6,9,17H,7-8H2,(H,18,19)
InChIKeyDISFMQXEPAMDKL-UHFFFAOYSA-N
MW317.19 g/mol
LogP3.67
Rot. Bonds2

About N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide

N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 43325607) has the molecular formula C15H13BrN2O and a molecular weight of 317.19 g/mol. Its IUPAC name is N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID43325607
Molecular FormulaC15H13BrN2O
Molecular Weight317.19 g/mol
Exact Mass316.02
IUPAC NameN-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESO=C(Nc1ccccc1Br)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H13BrN2O/c16-12-3-1-2-4-14(12)18-15(19)11-5-6-13-10(9-11)7-8-17-13/h1-6,9,17H,7-8H2,(H,18,19)
InChIKeyDISFMQXEPAMDKL-UHFFFAOYSA-N
XLogP3.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.19
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-bromo-2-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 104938285
N-(2-chlorophenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43325613
N-(2-chloro-3-pyridinyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43704526
N-(2-ethylsulfanylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 60927886
N-(2-iodophenyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 43325719
N-(3-bromo-2-methylphenyl)-2,3-dihydro-1H-indole-6-carboxamide
CID 107625093
N-(3-bromo-4-methylphenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 63334695
N-pyrimidin-2-yl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142516
N-(2-bromo-3-chlorophenyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 103479340
N-(1H-indazol-7-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43712758
N-(5-chloro-2-fluorophenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43438489
N-(2,3,4-trifluorophenyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43325563

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide (CID 43325607) is N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide is O=C(Nc1ccccc1Br)c1ccc2c(c1)CCN2.
What is the InChIKey of N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is DISFMQXEPAMDKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O/c16-12-3-1-2-4-14(12)18-15(19)11-5-6-13-10(9-11)7-8-17-13/h1-6,9,17H,7-8H2,(H,18,19).
What are the key properties of N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide?
N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 317.19 g/mol, XLogP of 3.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 43325607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).