N-benzyl-5-methyl-2-phenylpyrazol-3-amine

C17H17N3 — CID 15721950

IUPACN-benzyl-5-methyl-2-phenylpyrazol-3-amine
SMILESCc1cc(NCc2ccccc2)n(-c2ccccc2)n1
InChIInChI=1S/C17H17N3/c1-14-12-17(18-13-15-8-4-2-5-9-15)20(19-14)16-10-6-3-7-11-16/h2-12,18H,13H2,1H3
InChIKeyLCPNODUXUXCPEV-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.79
Rot. Bonds4

About N-benzyl-5-methyl-2-phenylpyrazol-3-amine

N-benzyl-5-methyl-2-phenylpyrazol-3-amine (PubChem CID 15721950) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-benzyl-5-methyl-2-phenylpyrazol-3-amine.

Molecular Properties

Compound NameN-benzyl-5-methyl-2-phenylpyrazol-3-amine
PubChem CID15721950
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC NameN-benzyl-5-methyl-2-phenylpyrazol-3-amine
SMILESCc1cc(NCc2ccccc2)n(-c2ccccc2)n1
InChIInChI=1S/C17H17N3/c1-14-12-17(18-13-15-8-4-2-5-9-15)20(19-14)16-10-6-3-7-11-16/h2-12,18H,13H2,1H3
InChIKeyLCPNODUXUXCPEV-UHFFFAOYSA-N
XLogP3.79
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Amino-3-methyl-1-phenylpyrazole
CID 70801
6-methyl-2-(3-methyl-5-((4-methylphenyl)amino)-1H-pyrazol-1-yl)-1,4-dihydropyrimidin-4-one
CID 135415440
Pyrazole, 5-amino-3-(p-aminophenyl)-1-phenyl-
CID 202779
1-benzyl-3-methyl-1H-pyrazol-5-amine
CID 769146
3-Methyl-1-(2-methylphenyl)-1H-pyrazol-5-amine
CID 775688
3-(3-methyl-1-phenyl-1H-pyrazol-5-yl)-1-phenylurea
CID 736191
3-Methyl-1,4-diphenyl-1H-pyrazol-5-amine
CID 619285
1-(1-(3-aminophenyl)-3-tert-butyl-1H-pyrazol-5-yl)-3-phenylurea
CID 10915062
N-(4-butylphenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4-amine
CID 16030702
1,3-Diphenyl-1H-pyrazol-5-amine
CID 199969
3-tert-butyl-1-phenyl-1H-pyrazol-5-amine
CID 770634
1-Methyl-3-phenyl-1H-pyrazol-5-amine
CID 517779

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-methyl-2-phenylpyrazol-3-amine?
The IUPAC name of N-benzyl-5-methyl-2-phenylpyrazol-3-amine (CID 15721950) is N-benzyl-5-methyl-2-phenylpyrazol-3-amine.
What is the SMILES notation for N-benzyl-5-methyl-2-phenylpyrazol-3-amine?
The canonical SMILES for N-benzyl-5-methyl-2-phenylpyrazol-3-amine is Cc1cc(NCc2ccccc2)n(-c2ccccc2)n1.
What is the InChIKey of N-benzyl-5-methyl-2-phenylpyrazol-3-amine?
The InChIKey is LCPNODUXUXCPEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-14-12-17(18-13-15-8-4-2-5-9-15)20(19-14)16-10-6-3-7-11-16/h2-12,18H,13H2,1H3.
What are the key properties of N-benzyl-5-methyl-2-phenylpyrazol-3-amine?
N-benzyl-5-methyl-2-phenylpyrazol-3-amine has a molecular weight of 263.34 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-methyl-2-phenylpyrazol-3-amine is sourced from PubChem (CID 15721950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).