N,1,5-trimethylindole-3-carboxamide

C12H14N2O — CID 25149961

IUPACN,1,5-trimethylindole-3-carboxamide
SMILESCNC(=O)c1cn(C)c2ccc(C)cc12
InChIInChI=1S/C12H14N2O/c1-8-4-5-11-9(6-8)10(7-14(11)3)12(15)13-2/h4-7H,1-3H3,(H,13,15)
InChIKeyPZRSBCCNPZAJBQ-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.85
Rot. Bonds1

About N,1,5-trimethylindole-3-carboxamide

N,1,5-trimethylindole-3-carboxamide (PubChem CID 25149961) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N,1,5-trimethylindole-3-carboxamide.

Molecular Properties

Compound NameN,1,5-trimethylindole-3-carboxamide
PubChem CID25149961
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN,1,5-trimethylindole-3-carboxamide
SMILESCNC(=O)c1cn(C)c2ccc(C)cc12
InChIInChI=1S/C12H14N2O/c1-8-4-5-11-9(6-8)10(7-14(11)3)12(15)13-2/h4-7H,1-3H3,(H,13,15)
InChIKeyPZRSBCCNPZAJBQ-UHFFFAOYSA-N
XLogP1.85
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,5-dimethylindole-3-carboxamide
CID 119084556
1-(1,5-dimethylindol-3-yl)-2-(methylamino)propan-1-one
CID 168925957
6-hydroxy-N,1-dimethylindole-3-carboxamide
CID 23572873
cyclopropyl-(1,5-dimethylindol-3-yl)methanone
CID 82278819
1-(1,5-dimethylindol-3-yl)-2-(ethylamino)butan-1-one
CID 162765617
(1,5-dimethylindol-3-yl)-piperidin-4-ylmethanone
CID 82499713
3-dimethylphosphoryl-1,5-dimethylindole
CID 170792902
1,5-dimethylindole-3-carbaldehyde
CID 1419073
CID 87065455
CID 87065455
2-(3-acetyl-5-methylindol-1-yl)-N-methylacetamide
CID 117098611
3-(1,5-dimethylindol-3-yl)sulfanyl-1,5-dimethylindole
CID 138983603
ethyl 2-(1,5-dimethylindol-3-yl)acetate
CID 84740898

Frequently Asked Questions

What is the IUPAC name of N,1,5-trimethylindole-3-carboxamide?
The IUPAC name of N,1,5-trimethylindole-3-carboxamide (CID 25149961) is N,1,5-trimethylindole-3-carboxamide.
What is the SMILES notation for N,1,5-trimethylindole-3-carboxamide?
The canonical SMILES for N,1,5-trimethylindole-3-carboxamide is CNC(=O)c1cn(C)c2ccc(C)cc12.
What is the InChIKey of N,1,5-trimethylindole-3-carboxamide?
The InChIKey is PZRSBCCNPZAJBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8-4-5-11-9(6-8)10(7-14(11)3)12(15)13-2/h4-7H,1-3H3,(H,13,15).
What are the key properties of N,1,5-trimethylindole-3-carboxamide?
N,1,5-trimethylindole-3-carboxamide has a molecular weight of 202.26 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,5-trimethylindole-3-carboxamide is sourced from PubChem (CID 25149961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).