(6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone

C15H12N2O — CID 43341972

IUPAC(6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone
SMILESCc1ccc2c(C(=O)c3cccnc3)c[nH]c2c1
InChIInChI=1S/C15H12N2O/c1-10-4-5-12-13(9-17-14(12)7-10)15(18)11-3-2-6-16-8-11/h2-9,17H,1H3
InChIKeySAHFVKLZTKFMGA-UHFFFAOYSA-N
MW236.27 g/mol
LogP3.10
Rot. Bonds2

About (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone

(6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone (PubChem CID 43341972) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone.

Molecular Properties

Compound Name(6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone
PubChem CID43341972
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name(6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone
SMILESCc1ccc2c(C(=O)c3cccnc3)c[nH]c2c1
InChIInChI=1S/C15H12N2O/c1-10-4-5-12-13(9-17-14(12)7-10)15(18)11-3-2-6-16-8-11/h2-9,17H,1H3
InChIKeySAHFVKLZTKFMGA-UHFFFAOYSA-N
XLogP3.10
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-amino-5-methylphenyl)-(6-methyl-1H-indol-3-yl)methanone
CID 65453793
(5-nitro-1H-indol-3-yl)-pyridin-3-ylmethanone
CID 43340513
(6-fluoro-1H-indol-3-yl)-(3-methylphenyl)methanone
CID 43342087
(3-bromo-4-methylphenyl)-(6-methyl-1H-indol-3-yl)methanone
CID 81472433
[5-methyl-2-(trifluoromethyl)phenyl]-pyridin-3-ylmethanone
CID 134622258
(4-amino-3-chlorophenyl)-(6-methyl-1H-indol-3-yl)methanone
CID 82787189
(2-bromo-3-methylphenyl)-(6-methyl-1H-indol-3-yl)methanone
CID 107981662
(2-ethoxy-5-methylphenyl)-pyridin-3-ylmethanone
CID 115000096
(5-anilino-1H-pyrrolo[2,3-b]pyridin-3-yl)-pyridin-3-ylmethanone
CID 58087201
(5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone
CID 43463712
(2-amino-5-methylphenyl)-(6-bromo-1H-indol-3-yl)methanone
CID 65455500
2-chloro-1-(6-methyl-1H-indol-3-yl)propan-1-one
CID 43163342

Frequently Asked Questions

What is the IUPAC name of (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone?
The IUPAC name of (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone (CID 43341972) is (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone.
What is the SMILES notation for (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone?
The canonical SMILES for (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone is Cc1ccc2c(C(=O)c3cccnc3)c[nH]c2c1.
What is the InChIKey of (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone?
The InChIKey is SAHFVKLZTKFMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-10-4-5-12-13(9-17-14(12)7-10)15(18)11-3-2-6-16-8-11/h2-9,17H,1H3.
What are the key properties of (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone?
(6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone has a molecular weight of 236.27 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone is sourced from PubChem (CID 43341972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).