3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine

C15H15N3O — CID 62830832

IUPAC3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine
SMILESCc1ccc(-c2c(-c3ccco3)nn(C)c2N)cc1
InChIInChI=1S/C15H15N3O/c1-10-5-7-11(8-6-10)13-14(12-4-3-9-19-12)17-18(2)15(13)16/h3-9H,16H2,1-2H3
InChIKeyZHIBEIJYFXJEPN-UHFFFAOYSA-N
MW253.31 g/mol
LogP3.24
Rot. Bonds2

About 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine

3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine (PubChem CID 62830832) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine.

Molecular Properties

Compound Name3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine
PubChem CID62830832
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine
SMILESCc1ccc(-c2c(-c3ccco3)nn(C)c2N)cc1
InChIInChI=1S/C15H15N3O/c1-10-5-7-11(8-6-10)13-14(12-4-3-9-19-12)17-18(2)15(13)16/h3-9H,16H2,1-2H3
InChIKeyZHIBEIJYFXJEPN-UHFFFAOYSA-N
XLogP3.24
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(Furan-2-yl)-2-methyl-3,7-diphenyl-6,7-dihydropyrazolo[1,5-a]pyrimidine
CID 666158
Methyl 4-[5-amino-3-(furan-2-yl)pyrazol-1-yl]benzoate
CID 162665882
4-[5-Amino-3-(furan-2-yl)pyrazol-1-yl]benzoic acid
CID 162677191
3-(Furan-2-yl)-1-phenyl-1h-pyrazol-5-amine
CID 12288137
1-(4-Fluorophenyl)-3-(furan-2-yl)pyrazol-5-amine
CID 16769813
3-(Furan-2-yl)-1-(4-methoxyphenyl)pyrazol-5-amine
CID 63173008
3-(Furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine
CID 162668421
2-(3,5-dimethylphenyl)-5-(furan-2-yl)-2,3-dihydro-1H-pyrazol-3-imine
CID 16770114
1-(3,5-Bis(trifluoromethyl)phenyl)-3-(furan-2-yl)-1H-pyrazol-5-amine
CID 2742742
N-[3-(2-furyl)-1H-pyrazol-5-yl]-N-(4-methoxybenzyl)amine
CID 57411902
N-(1-(4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-(furan-2-yl)-1H-pyrazol-5-yl)-4-(trifluoromethyl)benzamide
CID 135955413
N-[1-(1,6-Dihydro-4,5-dimethyl-6-oxo-2-pyrimidinyl)-3-(2-furanyl)-1H-pyrazol-5-yl]-4-fluorobenzeneacetamide
CID 135955422

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine?
The IUPAC name of 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine (CID 62830832) is 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine.
What is the SMILES notation for 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine?
The canonical SMILES for 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine is Cc1ccc(-c2c(-c3ccco3)nn(C)c2N)cc1.
What is the InChIKey of 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine?
The InChIKey is ZHIBEIJYFXJEPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-10-5-7-11(8-6-10)13-14(12-4-3-9-19-12)17-18(2)15(13)16/h3-9H,16H2,1-2H3.
What are the key properties of 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine?
3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine has a molecular weight of 253.31 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine is sourced from PubChem (CID 62830832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).