5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine

C15H18N4 — CID 84742218

IUPAC5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine
SMILESCCc1cccc2c(-c3cc(N)n[nH]3)c(C)n(C)c12
InChIInChI=1S/C15H18N4/c1-4-10-6-5-7-11-14(9(2)19(3)15(10)11)12-8-13(16)18-17-12/h5-8H,4H2,1-3H3,(H3,16,17,18)
InChIKeyBZTBGHFIICGJPC-UHFFFAOYSA-N
MW254.34 g/mol
LogP3.02
Rot. Bonds2

About 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine

5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine (PubChem CID 84742218) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine
PubChem CID84742218
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine
SMILESCCc1cccc2c(-c3cc(N)n[nH]3)c(C)n(C)c12
InChIInChI=1S/C15H18N4/c1-4-10-6-5-7-11-14(9(2)19(3)15(10)11)12-8-13(16)18-17-12/h5-8H,4H2,1-3H3,(H3,16,17,18)
InChIKeyBZTBGHFIICGJPC-UHFFFAOYSA-N
XLogP3.02
TPSA59.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine (CID 84742218) is 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine is CCc1cccc2c(-c3cc(N)n[nH]3)c(C)n(C)c12.
What is the InChIKey of 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine?
The InChIKey is BZTBGHFIICGJPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-4-10-6-5-7-11-14(9(2)19(3)15(10)11)12-8-13(16)18-17-12/h5-8H,4H2,1-3H3,(H3,16,17,18).
What are the key properties of 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine?
5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine has a molecular weight of 254.34 g/mol, XLogP of 3.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(7-ethyl-1,2-dimethylindol-3-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 84742218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).