4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine

C15H19N3O — CID 117397015

IUPAC4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine
SMILESCn1ncc(-c2cccc(OC3CCCC3)c2)c1N
InChIInChI=1S/C15H19N3O/c1-18-15(16)14(10-17-18)11-5-4-8-13(9-11)19-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7,16H2,1H3
InChIKeyPLKUGYYYMNYRNJ-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.99
Rot. Bonds3

About 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine

4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine (PubChem CID 117397015) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine
PubChem CID117397015
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine
SMILESCn1ncc(-c2cccc(OC3CCCC3)c2)c1N
InChIInChI=1S/C15H19N3O/c1-18-15(16)14(10-17-18)11-5-4-8-13(9-11)19-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7,16H2,1H3
InChIKeyPLKUGYYYMNYRNJ-UHFFFAOYSA-N
XLogP2.99
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-4-[4-(oxolan-3-yloxy)phenyl]pyrazol-5-amine
CID 117401972
4-(3-cyclohexyl-4-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117459944
4-[3-(difluoromethyl)phenyl]-1-methylpyrazol-5-amine
CID 117319243
4-(3-cyclopentyloxyphenyl)-2,6-difluoroaniline
CID 66997224
4-(3-bromo-4-cyclopropylphenyl)-1-methylpyrazol-5-amine
CID 117471763
4-(2-chloro-5-cyclobutyloxy-4-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117492733
4-[3-chloro-4-(1-methylpiperidin-4-yl)phenyl]-1-methylpyrazol-5-amine
CID 117490119
4-chloro-2-(3-cyclopentyloxyphenyl)-1-ethylbenzene
CID 123576563
3-(3-cyclopentyloxyphenyl)-7-(4-methoxyphenyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazine
CID 127243615
4-(3,4-dimethylphenyl)-1-methylpyrazol-5-amine
CID 62901487
1-bromo-3-cyclobutyloxybenzene;4-bromo-5-(3-cyclobutyloxyphenyl)-1-methylpyrazole;4-bromo-1-methylpyrazole;3-bromophenol
CID 157205073
(3-methylphenoxy)cyclononane
CID 145391482

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine (CID 117397015) is 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine is Cn1ncc(-c2cccc(OC3CCCC3)c2)c1N.
What is the InChIKey of 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine?
The InChIKey is PLKUGYYYMNYRNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18-15(16)14(10-17-18)11-5-4-8-13(9-11)19-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7,16H2,1H3.
What are the key properties of 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine?
4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine has a molecular weight of 257.34 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentyloxyphenyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 117397015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).