2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide

C14H17N5O2 — CID 97338410

IUPAC2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide
SMILESO=C(C[C@H]1CCCCO1)Nc1cncnc1-n1cccn1
InChIInChI=1S/C14H17N5O2/c20-13(8-11-4-1-2-7-21-11)18-12-9-15-10-16-14(12)19-6-3-5-17-19/h3,5-6,9-11H,1-2,4,7-8H2,(H,18,20)/t11-/m1/s1
InChIKeyBDIDWAYQFCOQTQ-LLVKDONJSA-N
MW287.32 g/mol
LogP1.56
Rot. Bonds4

About 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide

2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide (PubChem CID 97338410) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide
PubChem CID97338410
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC Name2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide
SMILESO=C(C[C@H]1CCCCO1)Nc1cncnc1-n1cccn1
InChIInChI=1S/C14H17N5O2/c20-13(8-11-4-1-2-7-21-11)18-12-9-15-10-16-14(12)19-6-3-5-17-19/h3,5-6,9-11H,1-2,4,7-8H2,(H,18,20)/t11-/m1/s1
InChIKeyBDIDWAYQFCOQTQ-LLVKDONJSA-N
XLogP1.56
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(oxan-2-yl)-N-(4-pyrrolidin-1-ylpyrimidin-5-yl)acetamide
CID 86791415
2-[(2S)-oxan-2-yl]-N-pyrazin-2-ylacetamide
CID 97309242
2-morpholin-2-yl-N-(2-pyrazol-1-yl-3-pyridinyl)acetamide;dihydrochloride
CID 119846885
2-(oxolan-2-yl)-N-pyridin-2-ylacetamide
CID 110696665
2-[3-[[2-[(2R)-oxan-2-yl]acetyl]amino]pyrazol-1-yl]acetic acid
CID 129402351
N-(4-pyrazol-1-ylpyrimidin-5-yl)-4-(trifluoromethyl)oxolane-2-carboxamide
CID 166318382
N-(1-benzyl-2-oxo-3-pyridinyl)-2-[(2S)-oxolan-2-yl]acetamide
CID 97053772
2-[(2R)-oxolan-2-yl]-N-(5-phenyl-2-pyridinyl)acetamide
CID 129403217
(3S)-5,6-dimethyl-N-(4-pyrazol-1-ylpyrimidin-5-yl)-2,3-dihydro-1-benzofuran-3-carboxamide
CID 124618677
N-(6-chloropyrazin-2-yl)-2-(oxolan-2-yl)acetamide
CID 104819962
2-[[2-(oxolan-2-yl)acetyl]amino]pyridine-3-carboxylic acid
CID 65157572
3-fluoro-4-[[2-[(2S)-oxan-2-yl]acetyl]amino]benzoic acid
CID 129372952

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide?
The IUPAC name of 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide (CID 97338410) is 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide.
What is the SMILES notation for 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide?
The canonical SMILES for 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide is O=C(C[C@H]1CCCCO1)Nc1cncnc1-n1cccn1.
What is the InChIKey of 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide?
The InChIKey is BDIDWAYQFCOQTQ-LLVKDONJSA-N. The full InChI is InChI=1S/C14H17N5O2/c20-13(8-11-4-1-2-7-21-11)18-12-9-15-10-16-14(12)19-6-3-5-17-19/h3,5-6,9-11H,1-2,4,7-8H2,(H,18,20)/t11-/m1/s1.
What are the key properties of 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide?
2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide has a molecular weight of 287.32 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-oxan-2-yl]-N-(4-pyrazol-1-ylpyrimidin-5-yl)acetamide is sourced from PubChem (CID 97338410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).