1-(1,3-diphenylpyrazol-5-yl)ethenamine

C17H15N3 — CID 170234692

IUPAC1-(1,3-diphenylpyrazol-5-yl)ethenamine
SMILESC=C(N)c1cc(-c2ccccc2)nn1-c1ccccc1
InChIInChI=1S/C17H15N3/c1-13(18)17-12-16(14-8-4-2-5-9-14)19-20(17)15-10-6-3-7-11-15/h2-12H,1,18H2
InChIKeyLOSWRQDVPZUVFO-UHFFFAOYSA-N
MW261.33 g/mol
LogP3.47
Rot. Bonds3

About 1-(1,3-diphenylpyrazol-5-yl)ethenamine

1-(1,3-diphenylpyrazol-5-yl)ethenamine (PubChem CID 170234692) has the molecular formula C17H15N3 and a molecular weight of 261.33 g/mol. Its IUPAC name is 1-(1,3-diphenylpyrazol-5-yl)ethenamine.

Molecular Properties

Compound Name1-(1,3-diphenylpyrazol-5-yl)ethenamine
PubChem CID170234692
Molecular FormulaC17H15N3
Molecular Weight261.33 g/mol
Exact Mass261.13
IUPAC Name1-(1,3-diphenylpyrazol-5-yl)ethenamine
SMILESC=C(N)c1cc(-c2ccccc2)nn1-c1ccccc1
InChIInChI=1S/C17H15N3/c1-13(18)17-12-16(14-8-4-2-5-9-14)19-20(17)15-10-6-3-7-11-15/h2-12H,1,18H2
InChIKeyLOSWRQDVPZUVFO-UHFFFAOYSA-N
XLogP3.47
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-diphenylpyrazole-5-carboximidamide
CID 170235177
4-[5-(1-hydrazinylethenyl)-1-phenylpyrazol-3-yl]aniline
CID 170234637
3-(4-methoxyphenyl)-1-phenylpyrazole-5-carboxamide
CID 10859327
1,3,5-triphenylpyrazole
CID 626614
1-phenyl-3-pyridin-3-ylpyrazole-5-carboxylic acid
CID 82370993
1-(2-phenylpyrazol-3-yl)ethenamine
CID 169217922
[2-(4-chlorophenyl)-2-oxoethyl] 1,3-diphenylpyrazole-5-carboxylate
CID 2400676
N-[(2R)-pentan-2-yl]-1,3-diphenylpyrazole-5-carboxamide
CID 7930702
1-(4-methylsulfonylphenyl)-3-phenylpyrazole-5-carboxylic acid
CID 91871448
3-(2,4-dihydroxyphenyl)-1-phenylpyrazole-5-carboxamide
CID 174927898
N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-1,3-diphenylpyrazole-5-carboxamide
CID 17465456
5-[(1,3-diphenylpyrazol-5-yl)-difluoromethyl]-1,3-diphenylpyrazole
CID 12640730

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-diphenylpyrazol-5-yl)ethenamine?
The IUPAC name of 1-(1,3-diphenylpyrazol-5-yl)ethenamine (CID 170234692) is 1-(1,3-diphenylpyrazol-5-yl)ethenamine.
What is the SMILES notation for 1-(1,3-diphenylpyrazol-5-yl)ethenamine?
The canonical SMILES for 1-(1,3-diphenylpyrazol-5-yl)ethenamine is C=C(N)c1cc(-c2ccccc2)nn1-c1ccccc1.
What is the InChIKey of 1-(1,3-diphenylpyrazol-5-yl)ethenamine?
The InChIKey is LOSWRQDVPZUVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3/c1-13(18)17-12-16(14-8-4-2-5-9-14)19-20(17)15-10-6-3-7-11-15/h2-12H,1,18H2.
What are the key properties of 1-(1,3-diphenylpyrazol-5-yl)ethenamine?
1-(1,3-diphenylpyrazol-5-yl)ethenamine has a molecular weight of 261.33 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-diphenylpyrazol-5-yl)ethenamine is sourced from PubChem (CID 170234692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).