N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide

C10H15N3O2 — CID 97209246

IUPACN-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide
SMILESCC(=O)Nc1ccnn1C[C@H]1CCOC1
InChIInChI=1S/C10H15N3O2/c1-8(14)12-10-2-4-11-13(10)6-9-3-5-15-7-9/h2,4,9H,3,5-7H2,1H3,(H,12,14)/t9-/m1/s1
InChIKeyZDLGFKBYXLDOSD-SECBINFHSA-N
MW209.25 g/mol
LogP0.88
Rot. Bonds3

About N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide

N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide (PubChem CID 97209246) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide.

Molecular Properties

Compound NameN-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide
PubChem CID97209246
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide
SMILESCC(=O)Nc1ccnn1C[C@H]1CCOC1
InChIInChI=1S/C10H15N3O2/c1-8(14)12-10-2-4-11-13(10)6-9-3-5-15-7-9/h2,4,9H,3,5-7H2,1H3,(H,12,14)/t9-/m1/s1
InChIKeyZDLGFKBYXLDOSD-SECBINFHSA-N
XLogP0.88
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide?
The IUPAC name of N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide (CID 97209246) is N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide.
What is the SMILES notation for N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide?
The canonical SMILES for N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide is CC(=O)Nc1ccnn1C[C@H]1CCOC1.
What is the InChIKey of N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide?
The InChIKey is ZDLGFKBYXLDOSD-SECBINFHSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8(14)12-10-2-4-11-13(10)6-9-3-5-15-7-9/h2,4,9H,3,5-7H2,1H3,(H,12,14)/t9-/m1/s1.
What are the key properties of N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide?
N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide has a molecular weight of 209.25 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[(3R)-oxolan-3-yl]methyl]pyrazol-3-yl]acetamide is sourced from PubChem (CID 97209246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).