1,5-dimethylindole-3-carboxamide

C11H12N2O — CID 119084556

IUPAC1,5-dimethylindole-3-carboxamide
SMILESCc1ccc2c(c1)c(C(N)=O)cn2C
InChIInChI=1S/C11H12N2O/c1-7-3-4-10-8(5-7)9(11(12)14)6-13(10)2/h3-6H,1-2H3,(H2,12,14)
InChIKeyMJFNTJYSZLDVCN-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.59
Rot. Bonds1

About 1,5-dimethylindole-3-carboxamide

1,5-dimethylindole-3-carboxamide (PubChem CID 119084556) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 1,5-dimethylindole-3-carboxamide.

Molecular Properties

Compound Name1,5-dimethylindole-3-carboxamide
PubChem CID119084556
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name1,5-dimethylindole-3-carboxamide
SMILESCc1ccc2c(c1)c(C(N)=O)cn2C
InChIInChI=1S/C11H12N2O/c1-7-3-4-10-8(5-7)9(11(12)14)6-13(10)2/h3-6H,1-2H3,(H2,12,14)
InChIKeyMJFNTJYSZLDVCN-UHFFFAOYSA-N
XLogP1.59
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-hydroxyethyl)-5-methylindole-3-carboxamide
CID 173096651
N,1,5-trimethylindole-3-carboxamide
CID 25149961
cyclopropyl-(1,5-dimethylindol-3-yl)methanone
CID 82278819
1,5-dimethylpyrrolo[2,3-b]pyridine-3-carboxamide
CID 59239700
1-(1,5-dimethylindol-3-yl)-2-(methylamino)propan-1-one
CID 168925957
(1,5-dimethylindol-3-yl)-piperidin-4-ylmethanone
CID 82499713
ethyl 2-(1,5-dimethylindol-3-yl)acetate
CID 84740898
1,5-dimethylindole-3-carbaldehyde
CID 1419073
1-(1,5-dimethylindol-3-yl)-2-(ethylamino)butan-1-one
CID 162765617
(Z)-1-(1,5-dimethylindol-3-yl)-2-pyrazin-2-ylethenamine
CID 143618673
3-(1,5-dimethylindol-3-yl)sulfanyl-1,5-dimethylindole
CID 138983603
3-dimethylphosphoryl-1,5-dimethylindole
CID 170792902

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethylindole-3-carboxamide?
The IUPAC name of 1,5-dimethylindole-3-carboxamide (CID 119084556) is 1,5-dimethylindole-3-carboxamide.
What is the SMILES notation for 1,5-dimethylindole-3-carboxamide?
The canonical SMILES for 1,5-dimethylindole-3-carboxamide is Cc1ccc2c(c1)c(C(N)=O)cn2C.
What is the InChIKey of 1,5-dimethylindole-3-carboxamide?
The InChIKey is MJFNTJYSZLDVCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-7-3-4-10-8(5-7)9(11(12)14)6-13(10)2/h3-6H,1-2H3,(H2,12,14).
What are the key properties of 1,5-dimethylindole-3-carboxamide?
1,5-dimethylindole-3-carboxamide has a molecular weight of 188.23 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethylindole-3-carboxamide is sourced from PubChem (CID 119084556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).