(2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide

C10H18FNO2 — CID 145214188

IUPAC(2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide
SMILESCCN(C[C@H](C)F)C(=O)[C@@H]1CCCO1
InChIInChI=1S/C10H18FNO2/c1-3-12(7-8(2)11)10(13)9-5-4-6-14-9/h8-9H,3-7H2,1-2H3/t8-,9-/m0/s1
InChIKeyMEYUVEXEMPEJIP-IUCAKERBSA-N
MW203.26 g/mol
LogP1.37
Rot. Bonds4

About (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide

(2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide (PubChem CID 145214188) has the molecular formula C10H18FNO2 and a molecular weight of 203.26 g/mol. Its IUPAC name is (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide
PubChem CID145214188
Molecular FormulaC10H18FNO2
Molecular Weight203.26 g/mol
Exact Mass203.13
IUPAC Name(2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide
SMILESCCN(C[C@H](C)F)C(=O)[C@@H]1CCCO1
InChIInChI=1S/C10H18FNO2/c1-3-12(7-8(2)11)10(13)9-5-4-6-14-9/h8-9H,3-7H2,1-2H3/t8-,9-/m0/s1
InChIKeyMEYUVEXEMPEJIP-IUCAKERBSA-N
XLogP1.37
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.26
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide?
The IUPAC name of (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide (CID 145214188) is (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide is CCN(C[C@H](C)F)C(=O)[C@@H]1CCCO1.
What is the InChIKey of (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide?
The InChIKey is MEYUVEXEMPEJIP-IUCAKERBSA-N. The full InChI is InChI=1S/C10H18FNO2/c1-3-12(7-8(2)11)10(13)9-5-4-6-14-9/h8-9H,3-7H2,1-2H3/t8-,9-/m0/s1.
What are the key properties of (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide?
(2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide has a molecular weight of 203.26 g/mol, XLogP of 1.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-ethyl-N-[(2S)-2-fluoropropyl]oxolane-2-carboxamide is sourced from PubChem (CID 145214188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).