N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide

C15H19N3O2 — CID 105058962

IUPACN-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide
SMILESCC(C(=O)NC(C)(CO)c1ccccc1)n1cccn1
InChIInChI=1S/C15H19N3O2/c1-12(18-10-6-9-16-18)14(20)17-15(2,11-19)13-7-4-3-5-8-13/h3-10,12,19H,11H2,1-2H3,(H,17,20)
InChIKeyVBXPTSYXEYVTLN-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.47
Rot. Bonds5

About N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide

N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide (PubChem CID 105058962) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide
PubChem CID105058962
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide
SMILESCC(C(=O)NC(C)(CO)c1ccccc1)n1cccn1
InChIInChI=1S/C15H19N3O2/c1-12(18-10-6-9-16-18)14(20)17-15(2,11-19)13-7-4-3-5-8-13/h3-10,12,19H,11H2,1-2H3,(H,17,20)
InChIKeyVBXPTSYXEYVTLN-UHFFFAOYSA-N
XLogP1.47
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4-(1-phenylethylamino)oxan-4-yl]methyl]-2-pyrazol-1-ylacetamide
CID 72015332
N-ethyl-2-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]-N-[2-(1H-pyrazol-1-yl)ethyl]acetamide
CID 72914729
3-(4-Fluorophenyl)-2-(3-pyrazol-1-ylpropylamino)propan-1-ol
CID 155119483
N-(2-hydroxy-3-phenylpropyl)-3-pyrazol-1-ylpropanamide
CID 71917505
N-[4-(3-fluorophenyl)oxan-4-yl]-2-pyrazol-1-ylpropanamide
CID 72118396
(2S)-2-[1-(4-bromopyrazol-1-yl)propan-2-ylamino]-2-phenylethanol
CID 75428123
1-[4-Hydroxy-2-[4-(trifluoromethyl)phenyl]pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
CID 75439866
1-[(1-ethylpyrazol-3-yl)methyl]-3-[(2R)-1-methoxy-2-phenylpropan-2-yl]urea
CID 164632841
N-[1-(3,5-difluorophenyl)-3-hydroxy-4-[[1-[3-(pyrazol-1-ylmethyl)phenyl]cyclopropyl]amino]butan-2-yl]acetamide
CID 16223647
N-[4-[[1-(1-tert-butylpyrazol-3-yl)cyclopropyl]amino]-1-(3,5-difluorophenyl)-3-hydroxybutan-2-yl]acetamide
CID 16224455
N-[1-(3,5-difluorophenyl)-3-hydroxy-4-[[1-(2-pyrazol-1-ylethoxymethyl)cyclopropyl]amino]butan-2-yl]acetamide
CID 16657562
N-[1-(3,5-difluorophenyl)-3-hydroxy-4-[[1-(4-pyrazol-1-ylbutyl)cyclopropyl]amino]butan-2-yl]acetamide
CID 16657628

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide (CID 105058962) is N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide is CC(C(=O)NC(C)(CO)c1ccccc1)n1cccn1.
What is the InChIKey of N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide?
The InChIKey is VBXPTSYXEYVTLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-12(18-10-6-9-16-18)14(20)17-15(2,11-19)13-7-4-3-5-8-13/h3-10,12,19H,11H2,1-2H3,(H,17,20).
What are the key properties of N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide?
N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide has a molecular weight of 273.34 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 105058962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).