(2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide

C16H19N3O2 — CID 95635352

IUPAC(2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide
SMILESO=C(Nc1cc(CCc2ccccc2)[nH]n1)[C@H]1CCCO1
InChIInChI=1S/C16H19N3O2/c20-16(14-7-4-10-21-14)17-15-11-13(18-19-15)9-8-12-5-2-1-3-6-12/h1-3,5-6,11,14H,4,7-10H2,(H2,17,18,19,20)/t14-/m1/s1
InChIKeyQUQDVTQIHITJNT-CQSZACIVSA-N
MW285.35 g/mol
LogP2.31
Rot. Bonds5

About (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide

(2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide (PubChem CID 95635352) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide
PubChem CID95635352
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name(2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide
SMILESO=C(Nc1cc(CCc2ccccc2)[nH]n1)[C@H]1CCCO1
InChIInChI=1S/C16H19N3O2/c20-16(14-7-4-10-21-14)17-15-11-13(18-19-15)9-8-12-5-2-1-3-6-12/h1-3,5-6,11,14H,4,7-10H2,(H2,17,18,19,20)/t14-/m1/s1
InChIKeyQUQDVTQIHITJNT-CQSZACIVSA-N
XLogP2.31
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(5-propyl-1H-pyrazol-3-yl)oxolane-2-carboxamide
CID 103873136
N-(5-propyl-1H-pyrazol-3-yl)oxane-2-carboxamide
CID 112702851
3-[[(2S)-oxolane-2-carbonyl]amino]-1H-pyrazole-5-carboxylic acid
CID 104855741
(2S)-N-(5-tert-butyl-1H-pyrazol-3-yl)oxolane-2-carboxamide
CID 113342671
(2S)-N-(5-propan-2-yl-1H-pyrazol-3-yl)oxolane-2-carboxamide
CID 103872756
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113028252
N-phenyloxolane-2-carboxamide
CID 3453643
(2R)-N-(1-benzylimidazol-2-yl)oxolane-2-carboxamide
CID 94211931
6-[[3-(oxolane-2-carbonylamino)phenyl]methylamino]pyridine-2-carboxylic acid
CID 122047903
(2R)-N-[5-(5-bromo-2-chlorophenyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide
CID 52517109
(2R)-N-(6-methyl-2-pyridinyl)oxolane-2-carboxamide
CID 40572544
N-[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]oxolane-2-carboxamide
CID 113030195

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide (CID 95635352) is (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide is O=C(Nc1cc(CCc2ccccc2)[nH]n1)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide?
The InChIKey is QUQDVTQIHITJNT-CQSZACIVSA-N. The full InChI is InChI=1S/C16H19N3O2/c20-16(14-7-4-10-21-14)17-15-11-13(18-19-15)9-8-12-5-2-1-3-6-12/h1-3,5-6,11,14H,4,7-10H2,(H2,17,18,19,20)/t14-/m1/s1.
What are the key properties of (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide?
(2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[5-(2-phenylethyl)-1H-pyrazol-3-yl]oxolane-2-carboxamide is sourced from PubChem (CID 95635352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).