7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide

C15H12ClN3O — CID 108804025

IUPAC7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide
SMILESCc1cccnc1NC(=O)c1cc2cccc(Cl)c2[nH]1
InChIInChI=1S/C15H12ClN3O/c1-9-4-3-7-17-14(9)19-15(20)12-8-10-5-2-6-11(16)13(10)18-12/h2-8,18H,1H3,(H,17,19,20)
InChIKeyHJGJDENPZCMSTO-UHFFFAOYSA-N
MW285.73 g/mol
LogP3.78
Rot. Bonds2

About 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide

7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide (PubChem CID 108804025) has the molecular formula C15H12ClN3O and a molecular weight of 285.73 g/mol. Its IUPAC name is 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide
PubChem CID108804025
Molecular FormulaC15H12ClN3O
Molecular Weight285.73 g/mol
Exact Mass285.07
IUPAC Name7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide
SMILESCc1cccnc1NC(=O)c1cc2cccc(Cl)c2[nH]1
InChIInChI=1S/C15H12ClN3O/c1-9-4-3-7-17-14(9)19-15(20)12-8-10-5-2-6-11(16)13(10)18-12/h2-8,18H,1H3,(H,17,19,20)
InChIKeyHJGJDENPZCMSTO-UHFFFAOYSA-N
XLogP3.78
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide?
The IUPAC name of 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide (CID 108804025) is 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide?
The canonical SMILES for 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide is Cc1cccnc1NC(=O)c1cc2cccc(Cl)c2[nH]1.
What is the InChIKey of 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide?
The InChIKey is HJGJDENPZCMSTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O/c1-9-4-3-7-17-14(9)19-15(20)12-8-10-5-2-6-11(16)13(10)18-12/h2-8,18H,1H3,(H,17,19,20).
What are the key properties of 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide?
7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide has a molecular weight of 285.73 g/mol, XLogP of 3.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 108804025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).