N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide

C16H13ClN2O2 — CID 113206063

IUPACN-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide
SMILESCOc1ccc2[nH]cc(C(=O)Nc3ccc(Cl)cc3)c2c1
InChIInChI=1S/C16H13ClN2O2/c1-21-12-6-7-15-13(8-12)14(9-18-15)16(20)19-11-4-2-10(17)3-5-11/h2-9,18H,1H3,(H,19,20)
InChIKeyCOVQLUUJFBCYFD-UHFFFAOYSA-N
MW300.75 g/mol
LogP4.08
Rot. Bonds3

About N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide

N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide (PubChem CID 113206063) has the molecular formula C16H13ClN2O2 and a molecular weight of 300.75 g/mol. Its IUPAC name is N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide
PubChem CID113206063
Molecular FormulaC16H13ClN2O2
Molecular Weight300.75 g/mol
Exact Mass300.07
IUPAC NameN-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide
SMILESCOc1ccc2[nH]cc(C(=O)Nc3ccc(Cl)cc3)c2c1
InChIInChI=1S/C16H13ClN2O2/c1-21-12-6-7-15-13(8-12)14(9-18-15)16(20)19-11-4-2-10(17)3-5-11/h2-9,18H,1H3,(H,19,20)
InChIKeyCOVQLUUJFBCYFD-UHFFFAOYSA-N
XLogP4.08
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.75
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dichlorophenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206126
5-methoxy-N-(4-methylphenyl)-1H-indole-3-carboxamide
CID 113206039
N-(3,4-dichlorophenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206123
5-methoxy-N-(3,4,5-trimethoxyphenyl)-1H-indole-3-carboxamide
CID 113206118
ethyl 4-[(5-methoxy-1H-indole-3-carbonyl)amino]benzoate
CID 113206116
6-methoxy-N-(4-methylphenyl)-4-oxo-1H-quinoline-3-carboxamide
CID 43831865
N-[2-(4-chlorophenyl)ethyl]-5-methoxy-1H-indole-3-carboxamide
CID 113206005
N-(4-bromophenyl)-6-methoxy-4-oxo-1H-quinoline-3-carboxamide
CID 43831869
5-chloro-N-(3,4,5-trimethoxyphenyl)-1H-indole-3-carboxamide
CID 113205929
N-(3-chloro-4-methoxyphenyl)-6-methoxy-1H-indole-3-carboxamide
CID 113206630
N-(2,4-dimethylphenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206042
N-(2,3-dimethylphenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206047

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide (CID 113206063) is N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide is COc1ccc2[nH]cc(C(=O)Nc3ccc(Cl)cc3)c2c1.
What is the InChIKey of N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide?
The InChIKey is COVQLUUJFBCYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2O2/c1-21-12-6-7-15-13(8-12)14(9-18-15)16(20)19-11-4-2-10(17)3-5-11/h2-9,18H,1H3,(H,19,20).
What are the key properties of N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide?
N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide has a molecular weight of 300.75 g/mol, XLogP of 4.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-5-methoxy-1H-indole-3-carboxamide is sourced from PubChem (CID 113206063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).