N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide

C15H11ClN2O2 — CID 64786778

IUPACN-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide
SMILESO=C(Nc1ccc(O)cc1Cl)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H11ClN2O2/c16-12-8-11(19)2-4-14(12)18-15(20)10-1-3-13-9(7-10)5-6-17-13/h1-8,17,19H,(H,18,20)
InChIKeyPQQDQJLNWRMDMF-UHFFFAOYSA-N
MW286.72 g/mol
LogP3.78
Rot. Bonds2

About N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide

N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide (PubChem CID 64786778) has the molecular formula C15H11ClN2O2 and a molecular weight of 286.72 g/mol. Its IUPAC name is N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide
PubChem CID64786778
Molecular FormulaC15H11ClN2O2
Molecular Weight286.72 g/mol
Exact Mass286.05
IUPAC NameN-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide
SMILESO=C(Nc1ccc(O)cc1Cl)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H11ClN2O2/c16-12-8-11(19)2-4-14(12)18-15(20)10-1-3-13-9(7-10)5-6-17-13/h1-8,17,19H,(H,18,20)
InChIKeyPQQDQJLNWRMDMF-UHFFFAOYSA-N
XLogP3.78
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.72
LogP ≤ 53.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxy-4-methylphenyl)-1H-indole-5-carboxamide
CID 63716979
3-chloro-N-(2-chloro-4-hydroxyphenyl)-4-hydroxybenzamide
CID 64787162
N-(4-fluoro-2-iodophenyl)-1H-indole-5-carboxamide
CID 79766806
4-bromo-N-(2-chloro-4-hydroxyphenyl)benzamide
CID 64786775
3,5-dichloro-N-(2-chloro-4-hydroxyphenyl)benzamide
CID 64788114
N-(2-cyanophenyl)-1H-indole-5-carboxamide
CID 63770547
N-(3-chlorophenyl)-1H-indole-5-carboxamide
CID 55230182
N-[3-chloro-4-[4-[[4-(4-hydroxypiperidin-1-yl)benzoyl]amino]anilino]phenyl]-1H-indole-5-carboxamide
CID 67113306
N-(2-chloro-4-hydroxyphenyl)-4-methoxybenzamide;N-(2-chloro-4-methoxyphenyl)-4-methoxybenzamide
CID 86605166
N-(5-methyl-1H-pyrazol-4-yl)-1H-indole-5-carboxamide
CID 112521790
N-(2-bromo-4-chlorophenyl)-1H-indole-6-carboxamide
CID 81024878
N-(3-methyl-4-pyridinyl)-1H-indole-5-carboxamide
CID 63719010

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide?
The IUPAC name of N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide (CID 64786778) is N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide.
What is the SMILES notation for N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide?
The canonical SMILES for N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide is O=C(Nc1ccc(O)cc1Cl)c1ccc2[nH]ccc2c1.
What is the InChIKey of N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide?
The InChIKey is PQQDQJLNWRMDMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O2/c16-12-8-11(19)2-4-14(12)18-15(20)10-1-3-13-9(7-10)5-6-17-13/h1-8,17,19H,(H,18,20).
What are the key properties of N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide?
N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide has a molecular weight of 286.72 g/mol, XLogP of 3.78, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-hydroxyphenyl)-1H-indole-5-carboxamide is sourced from PubChem (CID 64786778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).