4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine

C17H23N3O — CID 107179165

IUPAC4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine
SMILESCOc1ccc(-c2c(C3CCCC3C)nn(C)c2N)cc1
InChIInChI=1S/C17H23N3O/c1-11-5-4-6-14(11)16-15(17(18)20(2)19-16)12-7-9-13(21-3)10-8-12/h7-11,14H,4-6,18H2,1-3H3
InChIKeyYJXPLBBYQSWDNF-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.58
Rot. Bonds3

About 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine

4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine (PubChem CID 107179165) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine
PubChem CID107179165
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine
SMILESCOc1ccc(-c2c(C3CCCC3C)nn(C)c2N)cc1
InChIInChI=1S/C17H23N3O/c1-11-5-4-6-14(11)16-15(17(18)20(2)19-16)12-7-9-13(21-3)10-8-12/h7-11,14H,4-6,18H2,1-3H3
InChIKeyYJXPLBBYQSWDNF-UHFFFAOYSA-N
XLogP3.58
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclobutyl-4-(4-methoxyphenyl)-1-methylpyrazol-5-amine
CID 43158655
3-cyclobutyl-4-(3-methoxyphenyl)-1-methylpyrazol-5-amine
CID 61263855
3-(4-methoxyphenyl)-1-methyl-4-pyridin-4-ylpyrazol-5-amine
CID 80523679
4-(4-methoxyphenyl)-1-methyl-3-(1-methylpyrazol-3-yl)pyrazol-5-amine
CID 103118706
4-(3-methoxyphenyl)-1-methyl-3-(oxan-4-yl)pyrazol-5-amine
CID 62906563
3-cyclopropyl-1-methyl-4-pyridin-4-ylpyrazol-5-amine
CID 80524510
4-(4-methoxyphenyl)-1-methyl-3-(1-methylsulfonylethyl)pyrazol-5-amine
CID 104519661
4-(4-methoxyphenyl)-1-methyl-3-pyridin-2-ylpyrazol-5-amine
CID 62824966
3-(2-methylcyclopentyl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
CID 107179756
4-(4-fluorophenyl)-1-methyl-3-[1-(methylperoxymethyl)piperidin-4-yl]pyrazol-5-amine
CID 89200611
2-[4-(4-methoxyphenyl)phenyl]cyclopentan-1-amine
CID 69111845
5-(4-methoxyphenyl)-3-methyltriazol-4-amine
CID 83638320

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine?
The IUPAC name of 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine (CID 107179165) is 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine.
What is the SMILES notation for 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine?
The canonical SMILES for 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine is COc1ccc(-c2c(C3CCCC3C)nn(C)c2N)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine?
The InChIKey is YJXPLBBYQSWDNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-11-5-4-6-14(11)16-15(17(18)20(2)19-16)12-7-9-13(21-3)10-8-12/h7-11,14H,4-6,18H2,1-3H3.
What are the key properties of 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine?
4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine has a molecular weight of 285.39 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-1-methyl-3-(2-methylcyclopentyl)pyrazol-5-amine is sourced from PubChem (CID 107179165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).