1-benzyl-3-(furan-2-yl)pyrazol-5-amine

C14H13N3O — CID 15858676

IUPAC1-benzyl-3-(furan-2-yl)pyrazol-5-amine
SMILESNc1cc(-c2ccco2)nn1Cc1ccccc1
InChIInChI=1S/C14H13N3O/c15-14-9-12(13-7-4-8-18-13)16-17(14)10-11-5-2-1-3-6-11/h1-9H,10,15H2
InChIKeyXDWZGWJFCDFSOL-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.77
Rot. Bonds3

About 1-benzyl-3-(furan-2-yl)pyrazol-5-amine

1-benzyl-3-(furan-2-yl)pyrazol-5-amine (PubChem CID 15858676) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 1-benzyl-3-(furan-2-yl)pyrazol-5-amine.

Molecular Properties

Compound Name1-benzyl-3-(furan-2-yl)pyrazol-5-amine
PubChem CID15858676
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name1-benzyl-3-(furan-2-yl)pyrazol-5-amine
SMILESNc1cc(-c2ccco2)nn1Cc1ccccc1
InChIInChI=1S/C14H13N3O/c15-14-9-12(13-7-4-8-18-13)16-17(14)10-11-5-2-1-3-6-11/h1-9H,10,15H2
InChIKeyXDWZGWJFCDFSOL-UHFFFAOYSA-N
XLogP2.77
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-benzyl-3-(2,4-dichlorophenyl)pyrazol-5-amine
CID 43381349
1-(2-bromophenyl)-3-(furan-2-yl)pyrazol-5-amine
CID 43542912
5-amino-1-benzyl-3-(furan-2-yl)pyrazole-4-carbaldehyde
CID 82360760
3-(furan-2-yl)-1-pyrimidin-2-ylpyrazol-5-amine
CID 43531912
11-(furan-2-yl)-5-(2-phenylethyl)-4,5,7,9,10-pentazatricyclo[7.3.0.02,6]dodeca-1(12),2(6),3,7,10-pentaen-8-amine
CID 153187767
3-(5-bromofuran-2-yl)-1-(3-phenylpropyl)pyrazol-5-amine
CID 63266022
1-(3-bromophenyl)-3-(furan-2-yl)pyrazol-5-amine
CID 43542763
3-(5-bromofuran-2-yl)-1-[(3-methylphenyl)methyl]pyrazol-5-amine
CID 63275168
2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
CID 51589118
ethyl 2-[(4-benzylphenyl)methyl]-6-(furan-2-yl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate
CID 118423466
3-(furan-2-yl)-1-(3,4,5-trifluorophenyl)pyrazol-5-amine
CID 79194735
3-(2-chlorophenyl)-1-[(4-methylphenyl)methyl]pyrazol-5-amine
CID 43471217

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-(furan-2-yl)pyrazol-5-amine?
The IUPAC name of 1-benzyl-3-(furan-2-yl)pyrazol-5-amine (CID 15858676) is 1-benzyl-3-(furan-2-yl)pyrazol-5-amine.
What is the SMILES notation for 1-benzyl-3-(furan-2-yl)pyrazol-5-amine?
The canonical SMILES for 1-benzyl-3-(furan-2-yl)pyrazol-5-amine is Nc1cc(-c2ccco2)nn1Cc1ccccc1.
What is the InChIKey of 1-benzyl-3-(furan-2-yl)pyrazol-5-amine?
The InChIKey is XDWZGWJFCDFSOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c15-14-9-12(13-7-4-8-18-13)16-17(14)10-11-5-2-1-3-6-11/h1-9H,10,15H2.
What are the key properties of 1-benzyl-3-(furan-2-yl)pyrazol-5-amine?
1-benzyl-3-(furan-2-yl)pyrazol-5-amine has a molecular weight of 239.28 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-(furan-2-yl)pyrazol-5-amine is sourced from PubChem (CID 15858676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).