N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide

C26H25N3O — CID 46432019

IUPACN-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide
SMILESCC(NC(=O)c1ccc(Cn2cccn2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H25N3O/c1-20(25(22-9-4-2-5-10-22)23-11-6-3-7-12-23)28-26(30)24-15-13-21(14-16-24)19-29-18-8-17-27-29/h2-18,20,25H,19H2,1H3,(H,28,30)
InChIKeyKXZKBPMMCVSRFH-UHFFFAOYSA-N
MW395.51 g/mol
LogP4.88
Rot. Bonds7

About N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide

N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide (PubChem CID 46432019) has the molecular formula C26H25N3O and a molecular weight of 395.51 g/mol. Its IUPAC name is N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide
PubChem CID46432019
Molecular FormulaC26H25N3O
Molecular Weight395.51 g/mol
Exact Mass395.20
IUPAC NameN-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide
SMILESCC(NC(=O)c1ccc(Cn2cccn2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H25N3O/c1-20(25(22-9-4-2-5-10-22)23-11-6-3-7-12-23)28-26(30)24-15-13-21(14-16-24)19-29-18-8-17-27-29/h2-18,20,25H,19H2,1H3,(H,28,30)
InChIKeyKXZKBPMMCVSRFH-UHFFFAOYSA-N
XLogP4.88
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.51
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-1-phenylethyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 110001285
3-[[4-(pyrazol-1-ylmethyl)benzoyl]amino]butanoic acid
CID 119220723
N-(5-methylhexan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide
CID 46688121
N-(1-phenylbut-3-ynyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 71908993
N-(2-methylpropyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 18136496
N-[(1R)-1-(furan-2-yl)ethyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 42102024
N-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]-4-(pyrazol-1-ylmethyl)benzamide
CID 94668085
4-(acetamidomethyl)-N-(1,1-diphenylpropan-2-yl)benzamide
CID 134054915
N-(3-hydroxybutyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 111429261
4-methyl-2-[[[4-(pyrazol-1-ylmethyl)benzoyl]amino]methyl]pentanoic acid
CID 119252819
N-(2-phenyl-1-thiophen-2-ylethyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 86963245
N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 60551856

Frequently Asked Questions

What is the IUPAC name of N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide?
The IUPAC name of N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide (CID 46432019) is N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide.
What is the SMILES notation for N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide?
The canonical SMILES for N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide is CC(NC(=O)c1ccc(Cn2cccn2)cc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide?
The InChIKey is KXZKBPMMCVSRFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O/c1-20(25(22-9-4-2-5-10-22)23-11-6-3-7-12-23)28-26(30)24-15-13-21(14-16-24)19-29-18-8-17-27-29/h2-18,20,25H,19H2,1H3,(H,28,30).
What are the key properties of N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide?
N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide has a molecular weight of 395.51 g/mol, XLogP of 4.88, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1-diphenylpropan-2-yl)-4-(pyrazol-1-ylmethyl)benzamide is sourced from PubChem (CID 46432019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).