4-(4-ethoxyphenyl)-1H-pyrazol-5-amine

C11H13N3O — CID 970496

IUPAC4-(4-ethoxyphenyl)-1H-pyrazol-5-amine
SMILESCCOc1ccc(-c2cn[nH]c2N)cc1
InChIInChI=1S/C11H13N3O/c1-2-15-9-5-3-8(4-6-9)10-7-13-14-11(10)12/h3-7H,2H2,1H3,(H3,12,13,14)
InChIKeyMWGLCDXAHJMSHD-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.06
Rot. Bonds3

About 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine

4-(4-ethoxyphenyl)-1H-pyrazol-5-amine (PubChem CID 970496) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-1H-pyrazol-5-amine
PubChem CID970496
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name4-(4-ethoxyphenyl)-1H-pyrazol-5-amine
SMILESCCOc1ccc(-c2cn[nH]c2N)cc1
InChIInChI=1S/C11H13N3O/c1-2-15-9-5-3-8(4-6-9)10-7-13-14-11(10)12/h3-7H,2H2,1H3,(H3,12,13,14)
InChIKeyMWGLCDXAHJMSHD-UHFFFAOYSA-N
XLogP2.06
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,4-dimethoxyphenyl)-1H-pyrazol-5-amine
CID 737152
4-(4-methoxyphenyl)-1H-pyrazol-5-amine
CID 2766938
4-(4-methoxyphenyl)-3-methyl-1H-pyrazole
CID 2805464
4-(3,4,5-Trimethoxyphenyl)-1H-pyrazol-3-amine
CID 970677
5-(4-Butoxy-phenyl)-4-methyl-1H-pyrazole
CID 11322177
(E)-3-fluoro-2-[[4-(4-methyl-1H-pyrazol-5-yl)phenoxy]methyl]prop-2-en-1-amine
CID 146512238
(Z)-3-fluoro-2-[[4-(4-methyl-1H-pyrazol-5-yl)phenoxy]methyl]prop-2-en-1-amine
CID 162369033
4-(2,4-Dimethoxyphenyl)-1H-pyrazol-3-amine
CID 972218
4-(3,5-dimethoxyphenyl)-1H-pyrazol-5-amine
CID 978094
4-(3-Amino-1h-Pyrazol-4-Yl)phenol
CID 24841368
Phenol, p-(3-aminopyrazol-4-yl)-, hydrobromide
CID 24841367
4-(4-methoxyphenyl)-1H-pyrazole
CID 3596751

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine (CID 970496) is 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine is CCOc1ccc(-c2cn[nH]c2N)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine?
The InChIKey is MWGLCDXAHJMSHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-2-15-9-5-3-8(4-6-9)10-7-13-14-11(10)12/h3-7H,2H2,1H3,(H3,12,13,14).
What are the key properties of 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine?
4-(4-ethoxyphenyl)-1H-pyrazol-5-amine has a molecular weight of 203.24 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 970496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).