2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol

C13H24N2O2 — CID 114179967

IUPAC2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol
SMILESCCc1cnc(CNCC(CC)(CC)CO)o1
InChIInChI=1S/C13H24N2O2/c1-4-11-7-15-12(17-11)8-14-9-13(5-2,6-3)10-16/h7,14,16H,4-6,8-10H2,1-3H3
InChIKeyWSWUSFMHDBQXIE-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.13
Rot. Bonds8

About 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol

2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol (PubChem CID 114179967) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol
PubChem CID114179967
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol
SMILESCCc1cnc(CNCC(CC)(CC)CO)o1
InChIInChI=1S/C13H24N2O2/c1-4-11-7-15-12(17-11)8-14-9-13(5-2,6-3)10-16/h7,14,16H,4-6,8-10H2,1-3H3
InChIKeyWSWUSFMHDBQXIE-UHFFFAOYSA-N
XLogP2.13
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol 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

[5-(Propan-2-yl)-1,3-oxazol-2-yl]methanamine
CID 54594018
(1-((5-(Tert-butyl)oxazol-2-yl)methyl)piperidin-4-yl)methanol
CID 52274438
(S)-(1-((5-(tert-Butyl)oxazol-2-yl)methyl)pyrrolidin-2-yl)methanol
CID 53574116
(2S)-2-[(5-tert-butyl-1,3-oxazol-2-yl)methylamino]-3,3-dimethylbutanamide
CID 71983339
5-tert-butyl-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-1,3-oxazole-2-carboxamide
CID 75378945
(1S)-1-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]ethanamine
CID 97220325
2-methoxy-N-[[5-(2,2,2-trifluoroethyl)-1,3-oxazol-2-yl]methyl]ethanamine
CID 65181973
2-[(5-Tert-butyl-1,3-oxazol-2-yl)methylamino]-3,3,3-trifluoro-2-methylpropanoic acid
CID 79791610
1-[5-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]-N-methylmethanamine
CID 84766267
N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]-2-methoxyethanamine
CID 103311186
2-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol
CID 103856849
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-(2,2,2-trifluoroethoxy)ethanamine
CID 106370860

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol?
The IUPAC name of 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol (CID 114179967) is 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol.
What is the SMILES notation for 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol?
The canonical SMILES for 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol is CCc1cnc(CNCC(CC)(CC)CO)o1.
What is the InChIKey of 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol?
The InChIKey is WSWUSFMHDBQXIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-4-11-7-15-12(17-11)8-14-9-13(5-2,6-3)10-16/h7,14,16H,4-6,8-10H2,1-3H3.
What are the key properties of 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol?
2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol has a molecular weight of 240.35 g/mol, XLogP of 2.13, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-[[(5-ethyl-1,3-oxazol-2-yl)methylamino]methyl]butan-1-ol is sourced from PubChem (CID 114179967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).