7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide

C19H13ClN2O — CID 108791741

IUPAC7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc2ccccc2c1)c1cc2cccc(Cl)c2[nH]1
InChIInChI=1S/C19H13ClN2O/c20-16-7-3-6-14-11-17(22-18(14)16)19(23)21-15-9-8-12-4-1-2-5-13(12)10-15/h1-11,22H,(H,21,23)
InChIKeySGHSJMPDZMEKHF-UHFFFAOYSA-N
MW320.78 g/mol
LogP5.23
Rot. Bonds2

About 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide

7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide (PubChem CID 108791741) has the molecular formula C19H13ClN2O and a molecular weight of 320.78 g/mol. Its IUPAC name is 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide.

Molecular Properties

Compound Name7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide
PubChem CID108791741
Molecular FormulaC19H13ClN2O
Molecular Weight320.78 g/mol
Exact Mass320.07
IUPAC Name7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc2ccccc2c1)c1cc2cccc(Cl)c2[nH]1
InChIInChI=1S/C19H13ClN2O/c20-16-7-3-6-14-11-17(22-18(14)16)19(23)21-15-9-8-12-4-1-2-5-13(12)10-15/h1-11,22H,(H,21,23)
InChIKeySGHSJMPDZMEKHF-UHFFFAOYSA-N
XLogP5.23
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.78
LogP ≤ 55.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide
CID 108791596
7-chloro-N-(3-chloro-4-methoxyphenyl)-1H-indole-2-carboxamide
CID 108791613
7-chloro-N-(4-cyanophenyl)-1H-indole-2-carboxamide
CID 108791683
7-chloro-N-[3-(dimethylamino)phenyl]-1H-indole-2-carboxamide
CID 108791753
7-chloro-1H-indole-2-carbohydrazide
CID 13466352
7-chloro-N-[4-[(4-chlorophenyl)methoxy]phenyl]-1H-indole-2-carboxamide
CID 108791740
7-chloro-N-(2,6-diethylphenyl)-1H-indole-2-carboxamide
CID 108791658
N-naphthalen-2-yl-6-oxo-1H-pyridine-2-carboxamide
CID 107261405
N-naphthalen-2-yl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 141390644
7-chloro-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-1H-indole-2-carboxamide
CID 108791703
7-amino-N-(4-chlorophenyl)-1H-indole-2-carboxamide
CID 63117531
7-chloro-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-1H-indole-2-carboxamide
CID 108791702

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide?
The IUPAC name of 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide (CID 108791741) is 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide.
What is the SMILES notation for 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide?
The canonical SMILES for 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide is O=C(Nc1ccc2ccccc2c1)c1cc2cccc(Cl)c2[nH]1.
What is the InChIKey of 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide?
The InChIKey is SGHSJMPDZMEKHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClN2O/c20-16-7-3-6-14-11-17(22-18(14)16)19(23)21-15-9-8-12-4-1-2-5-13(12)10-15/h1-11,22H,(H,21,23).
What are the key properties of 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide?
7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide has a molecular weight of 320.78 g/mol, XLogP of 5.23, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide is sourced from PubChem (CID 108791741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).