3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide

C14H17F3N2O3 — CID 94118334

IUPAC3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide
SMILESO=C(CC[C@@H]1CCCO1)Nc1ccc(OCC(F)(F)F)nc1
InChIInChI=1S/C14H17F3N2O3/c15-14(16,17)9-22-13-6-3-10(8-18-13)19-12(20)5-4-11-2-1-7-21-11/h3,6,8,11H,1-2,4-5,7,9H2,(H,19,20)/t11-/m0/s1
InChIKeyLEGSVSMYPDMQQQ-NSHDSACASA-N
MW318.30 g/mol
LogP2.92
Rot. Bonds6

About 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide

3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide (PubChem CID 94118334) has the molecular formula C14H17F3N2O3 and a molecular weight of 318.30 g/mol. Its IUPAC name is 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide.

Molecular Properties

Compound Name3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide
PubChem CID94118334
Molecular FormulaC14H17F3N2O3
Molecular Weight318.30 g/mol
Exact Mass318.12
IUPAC Name3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide
SMILESO=C(CC[C@@H]1CCCO1)Nc1ccc(OCC(F)(F)F)nc1
InChIInChI=1S/C14H17F3N2O3/c15-14(16,17)9-22-13-6-3-10(8-18-13)19-12(20)5-4-11-2-1-7-21-11/h3,6,8,11H,1-2,4-5,7,9H2,(H,19,20)/t11-/m0/s1
InChIKeyLEGSVSMYPDMQQQ-NSHDSACASA-N
XLogP2.92
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.30
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-bromo-3-pyridinyl)-3-(oxolan-2-yl)propanamide
CID 103789254
N-(4-bromophenyl)-3-(oxolan-2-yl)propanamide
CID 42956700
6-amino-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]hexanamide
CID 43700692
N-(6-imidazol-1-yl-3-pyridinyl)-3-[(2R)-oxolan-2-yl]propanamide
CID 94177685
N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]morpholine-4-carboxamide
CID 47041273
N-[4-(4-ethoxyphenoxy)phenyl]-3-(oxolan-2-yl)propanamide
CID 55605765
N-[4-(2-chloroethyl)phenyl]-3-(oxolan-2-yl)propanamide
CID 114299310
4-benzamido-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]piperidine-1-carboxamide
CID 47041270
3-[(2S)-oxolan-2-yl]-N-pyridin-2-ylpropanamide
CID 51938440
N-[4-(N-hydroxy-C-methylcarbonimidoyl)phenyl]-3-(oxolan-2-yl)propanamide
CID 77057653
2-[5-[[2-(oxolan-2-yl)acetyl]amino]-2-pyridinyl]acetic acid
CID 107339211
N-(3-chloro-4-methylphenyl)-3-(oxolan-2-yl)propanamide
CID 42956710

Frequently Asked Questions

What is the IUPAC name of 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide?
The IUPAC name of 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide (CID 94118334) is 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide.
What is the SMILES notation for 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide?
The canonical SMILES for 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide is O=C(CC[C@@H]1CCCO1)Nc1ccc(OCC(F)(F)F)nc1.
What is the InChIKey of 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide?
The InChIKey is LEGSVSMYPDMQQQ-NSHDSACASA-N. The full InChI is InChI=1S/C14H17F3N2O3/c15-14(16,17)9-22-13-6-3-10(8-18-13)19-12(20)5-4-11-2-1-7-21-11/h3,6,8,11H,1-2,4-5,7,9H2,(H,19,20)/t11-/m0/s1.
What are the key properties of 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide?
3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide has a molecular weight of 318.30 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2S)-oxolan-2-yl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]propanamide is sourced from PubChem (CID 94118334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).