(2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide

C14H25NO3 — CID 86819653

IUPAC(2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide
SMILESCOCCN(C(=O)[C@@H]1CCCO1)C1CCC(C)C1
InChIInChI=1S/C14H25NO3/c1-11-5-6-12(10-11)15(7-9-17-2)14(16)13-4-3-8-18-13/h11-13H,3-10H2,1-2H3/t11?,12?,13-/m0/s1
InChIKeyMRMFOYZRRGIIBA-BPCQOVAHSA-N
MW255.36 g/mol
LogP1.83
Rot. Bonds5

About (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide

(2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide (PubChem CID 86819653) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide
PubChem CID86819653
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Name(2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide
SMILESCOCCN(C(=O)[C@@H]1CCCO1)C1CCC(C)C1
InChIInChI=1S/C14H25NO3/c1-11-5-6-12(10-11)15(7-9-17-2)14(16)13-4-3-8-18-13/h11-13H,3-10H2,1-2H3/t11?,12?,13-/m0/s1
InChIKeyMRMFOYZRRGIIBA-BPCQOVAHSA-N
XLogP1.83
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide?
The IUPAC name of (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide (CID 86819653) is (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide is COCCN(C(=O)[C@@H]1CCCO1)C1CCC(C)C1.
What is the InChIKey of (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide?
The InChIKey is MRMFOYZRRGIIBA-BPCQOVAHSA-N. The full InChI is InChI=1S/C14H25NO3/c1-11-5-6-12(10-11)15(7-9-17-2)14(16)13-4-3-8-18-13/h11-13H,3-10H2,1-2H3/t11?,12?,13-/m0/s1.
What are the key properties of (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide?
(2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 1.83, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-methoxyethyl)-N-(3-methylcyclopentyl)oxolane-2-carboxamide is sourced from PubChem (CID 86819653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).