4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine

C16H21N3O — CID 117431595

IUPAC4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine
SMILESCOc1ccc(C2CCCC2)cc1-c1cnn(C)c1N
InChIInChI=1S/C16H21N3O/c1-19-16(17)14(10-18-19)13-9-12(7-8-15(13)20-2)11-5-3-4-6-11/h7-11H,3-6,17H2,1-2H3
InChIKeyPLAAZLKZOPIIMG-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.34
Rot. Bonds3

About 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine

4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine (PubChem CID 117431595) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine
PubChem CID117431595
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine
SMILESCOc1ccc(C2CCCC2)cc1-c1cnn(C)c1N
InChIInChI=1S/C16H21N3O/c1-19-16(17)14(10-18-19)13-9-12(7-8-15(13)20-2)11-5-3-4-6-11/h7-11H,3-6,17H2,1-2H3
InChIKeyPLAAZLKZOPIIMG-UHFFFAOYSA-N
XLogP3.34
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-cyclohexyl-4-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117459944
4-(2-methoxy-5-pyrrolidin-1-ylphenyl)-1-methylpyrazol-5-amine
CID 117433956
4-[5-(1,1-difluoroethyl)-2-methoxyphenyl]-1-methylpyrazol-5-amine
CID 117421303
4-(2-methoxy-5-morpholin-4-ylphenyl)-1-methylpyrazol-5-amine
CID 117465938
5-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazole-3-carboxylic acid
CID 117484183
4-(4-chloro-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine
CID 117422678
4-(2-chloro-5-cyclobutyloxy-4-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117492733
4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine
CID 117370777
4-[4-(cyclopropylmethoxy)-3-methoxyphenyl]-1-methylpyrazol-5-amine
CID 117435948
1-methyl-4-[2-(1-methylazepan-4-yl)phenyl]pyrazol-5-amine
CID 117458050
5-(5-amino-1-methylpyrazol-4-yl)-4-methoxy-2-methylphenol
CID 117338196
4-(5-methoxy-1,3-benzoxathiol-6-yl)-1-methylpyrazol-5-amine
CID 117412695

Frequently Asked Questions

What is the IUPAC name of 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine (CID 117431595) is 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine is COc1ccc(C2CCCC2)cc1-c1cnn(C)c1N.
What is the InChIKey of 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine?
The InChIKey is PLAAZLKZOPIIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-19-16(17)14(10-18-19)13-9-12(7-8-15(13)20-2)11-5-3-4-6-11/h7-11H,3-6,17H2,1-2H3.
What are the key properties of 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine?
4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine has a molecular weight of 271.36 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 117431595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).