1-ethyl-5-phenylpyrazol-4-amine

C11H13N3 — CID 105442691

IUPAC1-ethyl-5-phenylpyrazol-4-amine
SMILESCCn1ncc(N)c1-c1ccccc1
InChIInChI=1S/C11H13N3/c1-2-14-11(10(12)8-13-14)9-6-4-3-5-7-9/h3-8H,2,12H2,1H3
InChIKeyLYXPEWOCYUTOSF-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.15
Rot. Bonds2

About 1-ethyl-5-phenylpyrazol-4-amine

1-ethyl-5-phenylpyrazol-4-amine (PubChem CID 105442691) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 1-ethyl-5-phenylpyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-5-phenylpyrazol-4-amine
PubChem CID105442691
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name1-ethyl-5-phenylpyrazol-4-amine
SMILESCCn1ncc(N)c1-c1ccccc1
InChIInChI=1S/C11H13N3/c1-2-14-11(10(12)8-13-14)9-6-4-3-5-7-9/h3-8H,2,12H2,1H3
InChIKeyLYXPEWOCYUTOSF-UHFFFAOYSA-N
XLogP2.15
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine
CID 105471347
5-(1,3-dihydroisoindol-2-ylmethyl)-1-ethylpyrazol-4-amine
CID 117217848
[1-ethyl-5-(3-methylphenyl)pyrazol-4-yl]methanamine
CID 105469022
4-(1-ethyl-4-methylpyrazol-5-yl)phenol
CID 136765379
5-(4-chlorophenyl)-1-ethylpyrazol-4-ol
CID 105480039
(4-amino-1-ethylpyrazol-5-yl)-(1,3-dihydroisoindol-2-yl)methanone
CID 65359057
[1-ethyl-5-(3-methoxyphenyl)pyrazol-4-yl]methanamine
CID 105489897
5-(2,3-dihydroindol-1-ylmethyl)-1-ethylpyrazol-4-amine
CID 117217840
1-[(2-chlorophenyl)methyl]-5-methylpyrazol-4-amine
CID 63276674
3-(1-ethyl-5-methylpyrazol-4-yl)-2-methylaniline
CID 107627213
5-(2-chlorophenyl)-1-ethylpyrazol-4-ol
CID 105480037
4-methyl-5-phenyl-1-(2-phenylethyl)pyrazole
CID 13353365

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-phenylpyrazol-4-amine?
The IUPAC name of 1-ethyl-5-phenylpyrazol-4-amine (CID 105442691) is 1-ethyl-5-phenylpyrazol-4-amine.
What is the SMILES notation for 1-ethyl-5-phenylpyrazol-4-amine?
The canonical SMILES for 1-ethyl-5-phenylpyrazol-4-amine is CCn1ncc(N)c1-c1ccccc1.
What is the InChIKey of 1-ethyl-5-phenylpyrazol-4-amine?
The InChIKey is LYXPEWOCYUTOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-14-11(10(12)8-13-14)9-6-4-3-5-7-9/h3-8H,2,12H2,1H3.
What are the key properties of 1-ethyl-5-phenylpyrazol-4-amine?
1-ethyl-5-phenylpyrazol-4-amine has a molecular weight of 187.25 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-phenylpyrazol-4-amine is sourced from PubChem (CID 105442691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).