3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine

C16H17N3O — CID 162668421

IUPAC3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine
SMILESCC(C)c1ccc(-n2nc(-c3ccco3)cc2N)cc1
InChIInChI=1S/C16H17N3O/c1-11(2)12-5-7-13(8-6-12)19-16(17)10-14(18-19)15-4-3-9-20-15/h3-11H,17H2,1-2H3
InChIKeyFHAYIIJKMHVSRS-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.84
Rot. Bonds3

About 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine

3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine (PubChem CID 162668421) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine.

Molecular Properties

Compound Name3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine
PubChem CID162668421
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine
SMILESCC(C)c1ccc(-n2nc(-c3ccco3)cc2N)cc1
InChIInChI=1S/C16H17N3O/c1-11(2)12-5-7-13(8-6-12)19-16(17)10-14(18-19)15-4-3-9-20-15/h3-11H,17H2,1-2H3
InChIKeyFHAYIIJKMHVSRS-UHFFFAOYSA-N
XLogP3.84
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-2-yl)pyrazolo[1,5-a]quinazolin-5(4H)-one
CID 135939586
Ethyl 3-(furan-2-yl)-1-(4-methylphenyl)pyrazole-5-carboxylate
CID 2366791
3-(5-Tert-butyl-2-methylfuran-3-yl)-1-(2-ethyl-6-methylphenyl)pyrazol-5-amine
CID 44526652
Methyl 4-[5-amino-3-(furan-2-yl)pyrazol-1-yl]benzoate
CID 162665882
4-[5-Azido-3-(furan-2-yl)pyrazol-1-yl]benzoic acid
CID 162676072
4-[5-Amino-3-(furan-2-yl)pyrazol-1-yl]benzoic acid
CID 162677191
1-[4-[3-[5-(2-furanyl)-1H-pyrazol-3-yl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]phenyl]ethanone
CID 1090776
N-[1-[3,5-bis(trifluoromethyl)phenyl]-3-(furan-2-yl)pyrazol-5-yl]cyclobutanecarboxamide
CID 2742771
3-(Furan-2-yl)-1-phenyl-1h-pyrazol-5-amine
CID 12288137
1-(4-Fluorophenyl)-3-(furan-2-yl)pyrazol-5-amine
CID 16769813
1-(4-chlorophenyl)-3-(furan-2-yl)-1H-pyrazol-5-amine
CID 43381275
3-(Furan-2-yl)-1-(4-methoxyphenyl)pyrazol-5-amine
CID 63173008

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine?
The IUPAC name of 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine (CID 162668421) is 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine.
What is the SMILES notation for 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine?
The canonical SMILES for 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine is CC(C)c1ccc(-n2nc(-c3ccco3)cc2N)cc1.
What is the InChIKey of 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine?
The InChIKey is FHAYIIJKMHVSRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-11(2)12-5-7-13(8-6-12)19-16(17)10-14(18-19)15-4-3-9-20-15/h3-11H,17H2,1-2H3.
What are the key properties of 3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine?
3-(furan-2-yl)-1-(4-propan-2-ylphenyl)pyrazol-5-amine has a molecular weight of 267.33 g/mol, XLogP of 3.84, 3 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-(4-propan-2-ylphenyl)pyrazol-5-amine is sourced from PubChem (CID 162668421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).