N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide

C16H19N3O3 — CID 91959923

IUPACN-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide
SMILESCc1c(C(=O)NC(CO)Cc2ccccc2)nn2c1OCC2
InChIInChI=1S/C16H19N3O3/c1-11-14(18-19-7-8-22-16(11)19)15(21)17-13(10-20)9-12-5-3-2-4-6-12/h2-6,13,20H,7-10H2,1H3,(H,17,21)
InChIKeyFXNUUXCCMPZARU-UHFFFAOYSA-N
MW301.35 g/mol
LogP0.92
Rot. Bonds5

About N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide

N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide (PubChem CID 91959923) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide
PubChem CID91959923
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide
SMILESCc1c(C(=O)NC(CO)Cc2ccccc2)nn2c1OCC2
InChIInChI=1S/C16H19N3O3/c1-11-14(18-19-7-8-22-16(11)19)15(21)17-13(10-20)9-12-5-3-2-4-6-12/h2-6,13,20H,7-10H2,1H3,(H,17,21)
InChIKeyFXNUUXCCMPZARU-UHFFFAOYSA-N
XLogP0.92
TPSA76.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(dimethylamino)-2-phenylethyl]-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide
CID 91959940
3-methyl-N-(1-phenylpropyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 91959391
3-methyl-N-(1-pyridin-2-ylethyl)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 91959527
4-amino-1-ethyl-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]pyrazole-3-carboxamide
CID 107860614
1-N,3-N,5-N-tris[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzene-1,3,5-tricarboxamide
CID 102400382
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2,5-dimethylpyrazole-3-carboxamide
CID 107861204
3-bromo-N-(1-hydroxy-3-phenylpropan-2-yl)-6-methylpyridine-2-carboxamide
CID 136564699
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-3-methyl-1,2,4-oxadiazole-5-carboxamide
CID 29135101
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]cyclohepta[c]pyrazole-3-carboxamide
CID 90910708
1-cyclopropyl-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]pyrrole-2-carboxamide
CID 107861229
1,3-bis(1-hydroxy-3-phenylpropan-2-yl)urea
CID 22088923
3-fluoro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-5-methylbenzamide
CID 102673606

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide?
The IUPAC name of N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide (CID 91959923) is N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide.
What is the SMILES notation for N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide?
The canonical SMILES for N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide is Cc1c(C(=O)NC(CO)Cc2ccccc2)nn2c1OCC2.
What is the InChIKey of N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide?
The InChIKey is FXNUUXCCMPZARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-11-14(18-19-7-8-22-16(11)19)15(21)17-13(10-20)9-12-5-3-2-4-6-12/h2-6,13,20H,7-10H2,1H3,(H,17,21).
What are the key properties of N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide?
N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-phenylpropan-2-yl)-7-methyl-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide is sourced from PubChem (CID 91959923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).