(2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide

C14H21N3O2 — CID 35535492

IUPAC(2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide
SMILESCc1cc(NC(=O)[C@@H]2CCCO2)n(C2CCCC2)n1
InChIInChI=1S/C14H21N3O2/c1-10-9-13(15-14(18)12-7-4-8-19-12)17(16-10)11-5-2-3-6-11/h9,11-12H,2-8H2,1H3,(H,15,18)/t12-/m0/s1
InChIKeyYGIRXOFYICAPJN-LBPRGKRZSA-N
MW263.34 g/mol
LogP2.42
Rot. Bonds3

About (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide

(2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide (PubChem CID 35535492) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide
PubChem CID35535492
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name(2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide
SMILESCc1cc(NC(=O)[C@@H]2CCCO2)n(C2CCCC2)n1
InChIInChI=1S/C14H21N3O2/c1-10-9-13(15-14(18)12-7-4-8-19-12)17(16-10)11-5-2-3-6-11/h9,11-12H,2-8H2,1H3,(H,15,18)/t12-/m0/s1
InChIKeyYGIRXOFYICAPJN-LBPRGKRZSA-N
XLogP2.42
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide?
The IUPAC name of (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide (CID 35535492) is (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide is Cc1cc(NC(=O)[C@@H]2CCCO2)n(C2CCCC2)n1.
What is the InChIKey of (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide?
The InChIKey is YGIRXOFYICAPJN-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-10-9-13(15-14(18)12-7-4-8-19-12)17(16-10)11-5-2-3-6-11/h9,11-12H,2-8H2,1H3,(H,15,18)/t12-/m0/s1.
What are the key properties of (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide?
(2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide is sourced from PubChem (CID 35535492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).