N,4,6-trimethyl-1H-indole-3-carboxamide

C12H14N2O — CID 118475596

IUPACN,4,6-trimethyl-1H-indole-3-carboxamide
SMILESCNC(=O)c1c[nH]c2cc(C)cc(C)c12
InChIInChI=1S/C12H14N2O/c1-7-4-8(2)11-9(12(15)13-3)6-14-10(11)5-7/h4-6,14H,1-3H3,(H,13,15)
InChIKeyIKPWVMVIAQPGMO-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.14
Rot. Bonds1

About N,4,6-trimethyl-1H-indole-3-carboxamide

N,4,6-trimethyl-1H-indole-3-carboxamide (PubChem CID 118475596) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N,4,6-trimethyl-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN,4,6-trimethyl-1H-indole-3-carboxamide
PubChem CID118475596
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN,4,6-trimethyl-1H-indole-3-carboxamide
SMILESCNC(=O)c1c[nH]c2cc(C)cc(C)c12
InChIInChI=1S/C12H14N2O/c1-7-4-8(2)11-9(12(15)13-3)6-14-10(11)5-7/h4-6,14H,1-3H3,(H,13,15)
InChIKeyIKPWVMVIAQPGMO-UHFFFAOYSA-N
XLogP2.14
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

methyl 2-(4,6-dimethyl-1H-indol-3-yl)-2-oxoacetate
CID 84740886
N,2,4,6-tetramethyl-1H-indole-3-carboxamide
CID 65335343
(4,6-dimethyl-1H-indol-3-yl)-pyrrolidin-2-ylmethanone
CID 84630313
N,6-dimethyl-4-oxo-1H-pyridine-3-carboxamide
CID 90091418
2-(4,6-dimethyl-1H-indol-3-yl)propanoic acid
CID 67337571
[6-methyl-3-[2-(methylamino)-2-oxoacetyl]-1H-indol-4-yl] acetate
CID 170790780
N'-cyclopropyl-4,6-dimethyl-1H-indole-3-carboximidamide
CID 137205934
2,2,2-trifluoro-1-(4-fluoro-6-methyl-1H-indol-3-yl)ethanone
CID 118654571
2-(4,6-dimethyl-1H-indol-3-yl)-N-methylpropan-2-amine
CID 84622454
5-chloro-6,7-dihydroxy-N-methyl-4-oxo-1H-quinoline-3-carboxamide
CID 118461158
4-(4,6-dimethyl-1H-indol-3-yl)butanoic acid
CID 82390563
5-bromo-N-methyl-1H-indole-3-carboxamide
CID 142746507

Frequently Asked Questions

What is the IUPAC name of N,4,6-trimethyl-1H-indole-3-carboxamide?
The IUPAC name of N,4,6-trimethyl-1H-indole-3-carboxamide (CID 118475596) is N,4,6-trimethyl-1H-indole-3-carboxamide.
What is the SMILES notation for N,4,6-trimethyl-1H-indole-3-carboxamide?
The canonical SMILES for N,4,6-trimethyl-1H-indole-3-carboxamide is CNC(=O)c1c[nH]c2cc(C)cc(C)c12.
What is the InChIKey of N,4,6-trimethyl-1H-indole-3-carboxamide?
The InChIKey is IKPWVMVIAQPGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-7-4-8(2)11-9(12(15)13-3)6-14-10(11)5-7/h4-6,14H,1-3H3,(H,13,15).
What are the key properties of N,4,6-trimethyl-1H-indole-3-carboxamide?
N,4,6-trimethyl-1H-indole-3-carboxamide has a molecular weight of 202.26 g/mol, XLogP of 2.14, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,6-trimethyl-1H-indole-3-carboxamide is sourced from PubChem (CID 118475596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).