2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide

C11H17N3O2 — CID 65160176

IUPAC2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide
SMILESCC1OC(C)C(C(=O)Nc2ccn[nH]2)C1C
InChIInChI=1S/C11H17N3O2/c1-6-7(2)16-8(3)10(6)11(15)13-9-4-5-12-14-9/h4-8,10H,1-3H3,(H2,12,13,14,15)
InChIKeyQJNQBMFTQRDEBF-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.41
Rot. Bonds2

About 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide

2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide (PubChem CID 65160176) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide
PubChem CID65160176
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide
SMILESCC1OC(C)C(C(=O)Nc2ccn[nH]2)C1C
InChIInChI=1S/C11H17N3O2/c1-6-7(2)16-8(3)10(6)11(15)13-9-4-5-12-14-9/h4-8,10H,1-3H3,(H2,12,13,14,15)
InChIKeyQJNQBMFTQRDEBF-UHFFFAOYSA-N
XLogP1.41
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide?
The IUPAC name of 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide (CID 65160176) is 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide.
What is the SMILES notation for 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide?
The canonical SMILES for 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide is CC1OC(C)C(C(=O)Nc2ccn[nH]2)C1C.
What is the InChIKey of 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide?
The InChIKey is QJNQBMFTQRDEBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-6-7(2)16-8(3)10(6)11(15)13-9-4-5-12-14-9/h4-8,10H,1-3H3,(H2,12,13,14,15).
What are the key properties of 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide?
2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 1.41, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-(1H-pyrazol-5-yl)oxolane-3-carboxamide is sourced from PubChem (CID 65160176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).