1-amino-N,4-dimethylindole-2-carboxamide

C11H13N3O — CID 67487856

IUPAC1-amino-N,4-dimethylindole-2-carboxamide
SMILESCNC(=O)c1cc2c(C)cccc2n1N
InChIInChI=1S/C11H13N3O/c1-7-4-3-5-9-8(7)6-10(14(9)12)11(15)13-2/h3-6H,12H2,1-2H3,(H,13,15)
InChIKeyIOQGWVJPBYLXAC-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.02
Rot. Bonds1

About 1-amino-N,4-dimethylindole-2-carboxamide

1-amino-N,4-dimethylindole-2-carboxamide (PubChem CID 67487856) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is 1-amino-N,4-dimethylindole-2-carboxamide.

Molecular Properties

Compound Name1-amino-N,4-dimethylindole-2-carboxamide
PubChem CID67487856
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name1-amino-N,4-dimethylindole-2-carboxamide
SMILESCNC(=O)c1cc2c(C)cccc2n1N
InChIInChI=1S/C11H13N3O/c1-7-4-3-5-9-8(7)6-10(14(9)12)11(15)13-2/h3-6H,12H2,1-2H3,(H,13,15)
InChIKeyIOQGWVJPBYLXAC-UHFFFAOYSA-N
XLogP1.02
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-1,4-dimethylindole-2-carboxamide
CID 110833489
1-ethyl-4-methylindole-2-carboxylic acid
CID 53408213
ethyl 2-(1-ethyl-4-methylindol-2-yl)-2-oxoacetate
CID 115072524
1,4-dimethyl-N-(pyridin-4-ylmethyl)indole-2-carboxamide
CID 110852155
3-(2-ethoxycarbonyl-4-methylindol-1-yl)propanoic acid
CID 15548945
4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indole-2-carboxylic acid
CID 125449025
2-(4-methylindol-1-yl)propanehydrazide
CID 63577949
1,4-dimethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
CID 110849661
ethane;N,2,3-trimethylbenzamide
CID 178108869
methyl 2-(1-ethyl-4-methylindol-2-yl)-2-hydroxyacetate
CID 115071961
methyl 2-amino-2-(1-ethyl-4-methylindol-2-yl)acetate
CID 115071957
1,4-dimethyl-2-propan-2-ylindole;oxalic acid
CID 19389733

Frequently Asked Questions

What is the IUPAC name of 1-amino-N,4-dimethylindole-2-carboxamide?
The IUPAC name of 1-amino-N,4-dimethylindole-2-carboxamide (CID 67487856) is 1-amino-N,4-dimethylindole-2-carboxamide.
What is the SMILES notation for 1-amino-N,4-dimethylindole-2-carboxamide?
The canonical SMILES for 1-amino-N,4-dimethylindole-2-carboxamide is CNC(=O)c1cc2c(C)cccc2n1N.
What is the InChIKey of 1-amino-N,4-dimethylindole-2-carboxamide?
The InChIKey is IOQGWVJPBYLXAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-7-4-3-5-9-8(7)6-10(14(9)12)11(15)13-2/h3-6H,12H2,1-2H3,(H,13,15).
What are the key properties of 1-amino-N,4-dimethylindole-2-carboxamide?
1-amino-N,4-dimethylindole-2-carboxamide has a molecular weight of 203.24 g/mol, XLogP of 1.02, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N,4-dimethylindole-2-carboxamide is sourced from PubChem (CID 67487856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).