N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine

C10H10F6N2O — CID 103311183

IUPACN-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
SMILESFC(F)(F)C(c1cnc(CNC2CC2)o1)C(F)(F)F
InChIInChI=1S/C10H10F6N2O/c11-9(12,13)8(10(14,15)16)6-3-18-7(19-6)4-17-5-1-2-5/h3,5,8,17H,1-2,4H2
InChIKeyPEENHFJWEGVGAA-UHFFFAOYSA-N
MW288.19 g/mol
LogP3.13
Rot. Bonds4

About N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine

N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine (PubChem CID 103311183) has the molecular formula C10H10F6N2O and a molecular weight of 288.19 g/mol. Its IUPAC name is N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
PubChem CID103311183
Molecular FormulaC10H10F6N2O
Molecular Weight288.19 g/mol
Exact Mass288.07
IUPAC NameN-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
SMILESFC(F)(F)C(c1cnc(CNC2CC2)o1)C(F)(F)F
InChIInChI=1S/C10H10F6N2O/c11-9(12,13)8(10(14,15)16)6-3-18-7(19-6)4-17-5-1-2-5/h3,5,8,17H,1-2,4H2
InChIKeyPEENHFJWEGVGAA-UHFFFAOYSA-N
XLogP3.13
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.19
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-[[5-(3-methylbutyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 65183913
2-[(cyclopentylamino)methyl]-1,3-oxazol-5-amine
CID 117187878
N-[[5-(4-tert-butylcyclohexyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 65184155
N-[[5-(3,5-dimethylphenyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 65184115
N-[[5-(2,3,4-trifluorophenyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 79755784
4-ethyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]cyclohexan-1-amine
CID 103275539
N-[[5-(3-chloro-4-fluorophenyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 82880087
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 103096714
N-[[5-(3-methyloxan-4-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 114241788
N-[[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 107185095
N-[[5-(2,3-dihydro-1H-inden-5-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 65184355
N-[[5-(3-chloro-4-methylphenyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 65183620

Frequently Asked Questions

What is the IUPAC name of N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine (CID 103311183) is N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine is FC(F)(F)C(c1cnc(CNC2CC2)o1)C(F)(F)F.
What is the InChIKey of N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine?
The InChIKey is PEENHFJWEGVGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F6N2O/c11-9(12,13)8(10(14,15)16)6-3-18-7(19-6)4-17-5-1-2-5/h3,5,8,17H,1-2,4H2.
What are the key properties of N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine?
N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine has a molecular weight of 288.19 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-oxazol-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 103311183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).