3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide

C16H15N3O — CID 176886851

IUPAC3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide
SMILESCc1ccncc1-c1[nH]c2ccc(C(N)=O)cc2c1C
InChIInChI=1S/C16H15N3O/c1-9-5-6-18-8-13(9)15-10(2)12-7-11(16(17)20)3-4-14(12)19-15/h3-8,19H,1-2H3,(H2,17,20)
InChIKeyXQRRBLZCSNYFKO-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.95
Rot. Bonds2

About 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide

3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide (PubChem CID 176886851) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide.

Molecular Properties

Compound Name3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide
PubChem CID176886851
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide
SMILESCc1ccncc1-c1[nH]c2ccc(C(N)=O)cc2c1C
InChIInChI=1S/C16H15N3O/c1-9-5-6-18-8-13(9)15-10(2)12-7-11(16(17)20)3-4-14(12)19-15/h3-8,19H,1-2H3,(H2,17,20)
InChIKeyXQRRBLZCSNYFKO-UHFFFAOYSA-N
XLogP2.95
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide?
The IUPAC name of 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide (CID 176886851) is 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide.
What is the SMILES notation for 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide?
The canonical SMILES for 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide is Cc1ccncc1-c1[nH]c2ccc(C(N)=O)cc2c1C.
What is the InChIKey of 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide?
The InChIKey is XQRRBLZCSNYFKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-9-5-6-18-8-13(9)15-10(2)12-7-11(16(17)20)3-4-14(12)19-15/h3-8,19H,1-2H3,(H2,17,20).
What are the key properties of 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide?
3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide has a molecular weight of 265.32 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(4-methyl-3-pyridinyl)-1H-indole-5-carboxamide is sourced from PubChem (CID 176886851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).