N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine

C17H19N3O — CID 62902277

IUPACN-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine
SMILESCC(C)n1cc(NC(c2ccccc2)c2ccco2)cn1
InChIInChI=1S/C17H19N3O/c1-13(2)20-12-15(11-18-20)19-17(16-9-6-10-21-16)14-7-4-3-5-8-14/h3-13,17,19H,1-2H3
InChIKeyCQUDXZDVIHCKDE-UHFFFAOYSA-N
MW281.36 g/mol
LogP4.26
Rot. Bonds5

About N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine

N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine (PubChem CID 62902277) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine.

Molecular Properties

Compound NameN-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine
PubChem CID62902277
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine
SMILESCC(C)n1cc(NC(c2ccccc2)c2ccco2)cn1
InChIInChI=1S/C17H19N3O/c1-13(2)20-12-15(11-18-20)19-17(16-9-6-10-21-16)14-7-4-3-5-8-14/h3-13,17,19H,1-2H3
InChIKeyCQUDXZDVIHCKDE-UHFFFAOYSA-N
XLogP4.26
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine?
The IUPAC name of N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine (CID 62902277) is N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine.
What is the SMILES notation for N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine?
The canonical SMILES for N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine is CC(C)n1cc(NC(c2ccccc2)c2ccco2)cn1.
What is the InChIKey of N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine?
The InChIKey is CQUDXZDVIHCKDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-13(2)20-12-15(11-18-20)19-17(16-9-6-10-21-16)14-7-4-3-5-8-14/h3-13,17,19H,1-2H3.
What are the key properties of N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine?
N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine has a molecular weight of 281.36 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl(phenyl)methyl]-1-propan-2-ylpyrazol-4-amine is sourced from PubChem (CID 62902277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).