5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine

C14H16N4 — CID 136986277

IUPAC5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine
SMILESCc1ccc2[nH]c(C)c(-c3c(N)cnn3C)c2c1
InChIInChI=1S/C14H16N4/c1-8-4-5-12-10(6-8)13(9(2)17-12)14-11(15)7-16-18(14)3/h4-7,17H,15H2,1-3H3
InChIKeyIQYRJVJUOBYEPR-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.77
Rot. Bonds1

About 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine

5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine (PubChem CID 136986277) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine.

Molecular Properties

Compound Name5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine
PubChem CID136986277
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC Name5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine
SMILESCc1ccc2[nH]c(C)c(-c3c(N)cnn3C)c2c1
InChIInChI=1S/C14H16N4/c1-8-4-5-12-10(6-8)13(9(2)17-12)14-11(15)7-16-18(14)3/h4-7,17H,15H2,1-3H3
InChIKeyIQYRJVJUOBYEPR-UHFFFAOYSA-N
XLogP2.77
TPSA59.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(5-methoxy-2-methyl-1H-indol-3-yl)-1-methylpyrazol-4-amine
CID 136986323
1-methyl-5-(6-methyl-1H-indol-2-yl)pyrazol-4-amine
CID 136986433
5-(5-chloro-2-methyl-1H-indol-3-yl)-1-methylpyrazole-4-carboxylic acid
CID 136986309
5-(5-methoxy-2-methyl-1H-indol-3-yl)-1-methylpyrazole-4-carboxylic acid
CID 136986331
2-(4-amino-1-methylpyrazol-5-yl)-1H-indol-4-ol
CID 136986499
3,6-dimethyl-9H-carbazole
CID 144942624
2,3,5-trimethyl-1H-indole;vanadium
CID 159816698
5-(5-chloro-1H-indol-3-yl)-1-methylpyrazol-4-amine
CID 136986292
6-methyl-9H-pyrido[3,4-b]indol-3-amine
CID 115021046
4-(2,5-dimethyl-1H-indol-3-yl)-6,8-dimethylquinoline
CID 66651924
5-(4-fluorophenyl)-1-methylpyrazol-4-amine
CID 28803587
1-chloro-4-(2,5-dimethyl-1H-indol-3-yl)phthalazine
CID 87287590

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine?
The IUPAC name of 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine (CID 136986277) is 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine.
What is the SMILES notation for 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine?
The canonical SMILES for 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine is Cc1ccc2[nH]c(C)c(-c3c(N)cnn3C)c2c1.
What is the InChIKey of 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine?
The InChIKey is IQYRJVJUOBYEPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c1-8-4-5-12-10(6-8)13(9(2)17-12)14-11(15)7-16-18(14)3/h4-7,17H,15H2,1-3H3.
What are the key properties of 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine?
5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine has a molecular weight of 240.31 g/mol, XLogP of 2.77, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethyl-1H-indol-3-yl)-1-methylpyrazol-4-amine is sourced from PubChem (CID 136986277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).