1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine

C12H15N3O — CID 105471347

IUPAC1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine
SMILESCCn1ncc(N)c1-c1ccc(OC)cc1
InChIInChI=1S/C12H15N3O/c1-3-15-12(11(13)8-14-15)9-4-6-10(16-2)7-5-9/h4-8H,3,13H2,1-2H3
InChIKeyLXUYCSHJSZZVBM-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.16
Rot. Bonds3

About 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine

1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine (PubChem CID 105471347) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine
PubChem CID105471347
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine
SMILESCCn1ncc(N)c1-c1ccc(OC)cc1
InChIInChI=1S/C12H15N3O/c1-3-15-12(11(13)8-14-15)9-4-6-10(16-2)7-5-9/h4-8H,3,13H2,1-2H3
InChIKeyLXUYCSHJSZZVBM-UHFFFAOYSA-N
XLogP2.16
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-methoxyphenyl)-1-methylpyrazol-4-amine
CID 28803590
1-ethyl-5-phenylpyrazol-4-amine
CID 105442691
1-ethyl-5-(4-methoxyphenyl)triazol-4-amine
CID 105472459
5-ethyl-1-(4-methoxyphenyl)pyrazol-4-amine
CID 66441037
[1-ethyl-5-(3-methoxyphenyl)pyrazol-4-yl]methanamine
CID 105489897
1-ethyl-5-[(3-methoxyphenoxy)methyl]pyrazol-4-amine
CID 117217960
1-ethyl-4-isocyano-3-(4-methoxyphenyl)pyrazol-5-amine
CID 158935224
1-ethyl-3,5-bis(4-methoxyphenyl)-1,2,4-triazol-4-ium-4-amine
CID 158695674
[1-ethyl-3-(4-methoxyphenyl)pyrazol-5-yl]methanamine
CID 84761591
1-[(4-methoxyphenyl)methyl]-4-(6-methoxy-3-pyridinyl)pyrazol-5-amine
CID 70925358
4-(1-ethyl-4-methylpyrazol-5-yl)phenol
CID 136765379
5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol
CID 105491179

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine?
The IUPAC name of 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine (CID 105471347) is 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine.
What is the SMILES notation for 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine?
The canonical SMILES for 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine is CCn1ncc(N)c1-c1ccc(OC)cc1.
What is the InChIKey of 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine?
The InChIKey is LXUYCSHJSZZVBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-3-15-12(11(13)8-14-15)9-4-6-10(16-2)7-5-9/h4-8H,3,13H2,1-2H3.
What are the key properties of 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine?
1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine has a molecular weight of 217.27 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine is sourced from PubChem (CID 105471347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).