(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide

C16H20N4O2 — CID 128966406

IUPAC(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide
SMILESCc1cncc(CNC(=O)[C@@H]2CCO[C@H]2c2ccnn2C)c1
InChIInChI=1S/C16H20N4O2/c1-11-7-12(9-17-8-11)10-18-16(21)13-4-6-22-15(13)14-3-5-19-20(14)2/h3,5,7-9,13,15H,4,6,10H2,1-2H3,(H,18,21)/t13-,15-/m1/s1
InChIKeyKFURLNIVYAQQEO-UKRRQHHQSA-N
MW300.36 g/mol
LogP1.52
Rot. Bonds4

About (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide

(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide (PubChem CID 128966406) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide
PubChem CID128966406
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide
SMILESCc1cncc(CNC(=O)[C@@H]2CCO[C@H]2c2ccnn2C)c1
InChIInChI=1S/C16H20N4O2/c1-11-7-12(9-17-8-11)10-18-16(21)13-4-6-22-15(13)14-3-5-19-20(14)2/h3,5,7-9,13,15H,4,6,10H2,1-2H3,(H,18,21)/t13-,15-/m1/s1
InChIKeyKFURLNIVYAQQEO-UKRRQHHQSA-N
XLogP1.52
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3R)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-methylpyrazol-3-yl)oxolane-3-carboxamide
CID 128973125
(2R,3R)-N-[(2-methoxy-3-pyridinyl)methyl]-2-(2-methylpyrazol-3-yl)oxolane-3-carboxamide
CID 129000051
(2R,3R)-2-(2-methylpyrazol-3-yl)-N-(thiolan-2-ylmethyl)oxolane-3-carboxamide
CID 129000954
(2R,3R)-N-(2-ethylpyrimidin-5-yl)-2-(2-methylpyrazol-3-yl)oxolane-3-carboxamide
CID 129001573
(2R,3R)-N-[(1-methylbenzimidazol-2-yl)methyl]-2-(2-methylpyrazol-3-yl)oxane-3-carboxamide
CID 128975623
(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[[(2R)-2-methylthiolan-2-yl]methyl]oxolane-3-carboxamide
CID 129335251
N-[(3-methylphenyl)methyl]-2-[5-[(2R,3R)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]-1,2,4-oxadiazol-3-yl]acetamide
CID 126813533
(2R,3R)-N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-2-(2-methylpyrazol-3-yl)oxane-3-carboxamide
CID 128984992
(2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide
CID 136586841
(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide
CID 128995898
(2R,3R)-N-(1-methylpyrazol-4-yl)-2-(2-methylpyrazol-3-yl)oxane-3-carboxamide
CID 154738421
(2S,3S)-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-[2-(3-methoxypropyl)pyrazol-3-yl]oxolane-3-carboxamide
CID 128974294

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide?
The IUPAC name of (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide (CID 128966406) is (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide.
What is the SMILES notation for (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide?
The canonical SMILES for (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide is Cc1cncc(CNC(=O)[C@@H]2CCO[C@H]2c2ccnn2C)c1.
What is the InChIKey of (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide?
The InChIKey is KFURLNIVYAQQEO-UKRRQHHQSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-11-7-12(9-17-8-11)10-18-16(21)13-4-6-22-15(13)14-3-5-19-20(14)2/h3,5,7-9,13,15H,4,6,10H2,1-2H3,(H,18,21)/t13-,15-/m1/s1.
What are the key properties of (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide?
(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide is sourced from PubChem (CID 128966406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).