[4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine

C7H11FN2O — CID 84763995

IUPAC[4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine
SMILESCC(C)(F)c1coc(CN)n1
InChIInChI=1S/C7H11FN2O/c1-7(2,8)5-4-11-6(3-9)10-5/h4H,3,9H2,1-2H3
InChIKeyHHKJCOVPIKOSIW-UHFFFAOYSA-N
MW158.18 g/mol
LogP1.34
Rot. Bonds2

About [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine

[4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine (PubChem CID 84763995) has the molecular formula C7H11FN2O and a molecular weight of 158.18 g/mol. Its IUPAC name is [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine
PubChem CID84763995
Molecular FormulaC7H11FN2O
Molecular Weight158.18 g/mol
Exact Mass158.09
IUPAC Name[4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine
SMILESCC(C)(F)c1coc(CN)n1
InChIInChI=1S/C7H11FN2O/c1-7(2,8)5-4-11-6(3-9)10-5/h4H,3,9H2,1-2H3
InChIKeyHHKJCOVPIKOSIW-UHFFFAOYSA-N
XLogP1.34
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.18
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine 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

2-ethyl-4-(1-fluoro-2-methylpropan-2-yl)-1,3-oxazole
CID 155709555
2-(aminomethyl)-1,3-oxazole-4-carboxylic acid;2,2,2-trifluoroacetic acid
CID 154577366
[5-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine
CID 84764000
(4-prop-1-enyl-1,3-oxazol-2-yl)methanamine
CID 141104267
4-tert-butyl-2-(3,3-dimethylbutyl)-1,3-oxazole
CID 139460691
[4-[4-(trifluoromethoxy)phenyl]-1,3-oxazol-2-yl]methanamine;hydrochloride
CID 157332265
[4-[(4-fluorophenyl)methyl]-1,3-oxazol-2-yl]methanamine
CID 115024489
[4-(2,4,6-trimethylphenyl)-1,3-oxazol-2-yl]methanamine
CID 82284932
[6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine
CID 142385904
2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole
CID 89177733
[3-[2-(2-fluoropropan-2-yl)phenyl]-1,2,4-oxadiazol-5-yl]methanamine
CID 117342084
[4-(4-bromophenyl)-1,3-oxazol-2-yl]methanamine
CID 82298406

Frequently Asked Questions

What is the IUPAC name of [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine (CID 84763995) is [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine is CC(C)(F)c1coc(CN)n1.
What is the InChIKey of [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine?
The InChIKey is HHKJCOVPIKOSIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FN2O/c1-7(2,8)5-4-11-6(3-9)10-5/h4H,3,9H2,1-2H3.
What are the key properties of [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine?
[4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine has a molecular weight of 158.18 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-fluoropropan-2-yl)-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 84763995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).