1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine

C16H21N3O2 — CID 83203633

IUPAC1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine
SMILESCOc1ccc(-c2nn(C3CCCC3)cc2N)c(OC)c1
InChIInChI=1S/C16H21N3O2/c1-20-12-7-8-13(15(9-12)21-2)16-14(17)10-19(18-16)11-5-3-4-6-11/h7-11H,3-6,17H2,1-2H3
InChIKeyHDZDXHLGQFUJOU-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.26
Rot. Bonds4

About 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine

1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine (PubChem CID 83203633) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine
PubChem CID83203633
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine
SMILESCOc1ccc(-c2nn(C3CCCC3)cc2N)c(OC)c1
InChIInChI=1S/C16H21N3O2/c1-20-12-7-8-13(15(9-12)21-2)16-14(17)10-19(18-16)11-5-3-4-6-11/h7-11H,3-6,17H2,1-2H3
InChIKeyHDZDXHLGQFUJOU-UHFFFAOYSA-N
XLogP3.26
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopentyl-3-(3,5-dimethylphenyl)pyrazol-4-amine
CID 83222719
2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine
CID 62483621
2-cyclopropyl-4-(2,4-dimethoxyphenyl)-1,3-thiazol-5-amine
CID 62077685
2-(2,4-dimethoxyphenyl)-3-methoxypyridin-4-amine
CID 77093303
3-(2,4-dimethoxyphenyl)-4-ethyl-1-methylpyrazol-5-amine
CID 43670816
(4S)-1-cyclohexyl-4-[5-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one
CID 99746308
5-(2,4-dimethoxyphenyl)-2-methyl-3-prop-2-enylimidazol-4-amine
CID 62224887
4-(2,4-dimethoxyphenyl)imidazole-1,2-diamine
CID 82290592
4-(2,4-dimethoxyphenyl)-2,6-dimethylpyrimidin-5-amine
CID 82484014
1-[2-(2,4-dimethoxyphenyl)phenyl]-2,4-dimethoxybenzene
CID 70200625
4-(4-cyclohexyl-1,2,4-triazol-3-yl)-3-methoxyaniline
CID 107209647
2-cyclopentyl-4-(2,5-dimethoxyphenyl)-1,3-thiazol-5-amine
CID 62075863

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine?
The IUPAC name of 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine (CID 83203633) is 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine.
What is the SMILES notation for 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine?
The canonical SMILES for 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine is COc1ccc(-c2nn(C3CCCC3)cc2N)c(OC)c1.
What is the InChIKey of 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine?
The InChIKey is HDZDXHLGQFUJOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-20-12-7-8-13(15(9-12)21-2)16-14(17)10-19(18-16)11-5-3-4-6-11/h7-11H,3-6,17H2,1-2H3.
What are the key properties of 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine?
1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine has a molecular weight of 287.36 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(2,4-dimethoxyphenyl)pyrazol-4-amine is sourced from PubChem (CID 83203633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).