N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine

C10H18F3NO — CID 66206377

IUPACN-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine
SMILESCCCC1CC(NC)(C(F)(F)F)CCO1
InChIInChI=1S/C10H18F3NO/c1-3-4-8-7-9(14-2,5-6-15-8)10(11,12)13/h8,14H,3-7H2,1-2H3
InChIKeyTZWBDFFTRBUUSN-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.49
Rot. Bonds3

About N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine

N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine (PubChem CID 66206377) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine.

Molecular Properties

Compound NameN-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine
PubChem CID66206377
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC NameN-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine
SMILESCCCC1CC(NC)(C(F)(F)F)CCO1
InChIInChI=1S/C10H18F3NO/c1-3-4-8-7-9(14-2,5-6-15-8)10(11,12)13/h8,14H,3-7H2,1-2H3
InChIKeyTZWBDFFTRBUUSN-UHFFFAOYSA-N
XLogP2.49
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,1-dimethyl-4-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 167021574
2-[2-[(4,4-difluorocyclohexyl)amino]propyl]-N-methyl-4-(trifluoromethyl)oxan-4-amine
CID 169587954
1-(5,5-difluoro-6-propan-2-yloxan-2-yl)-N-methylmethanamine
CID 178984973
2-propyl-N-[4-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 64100729
2-propan-2-yl-N-[4-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 64100931
2-propyl-N-[3-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 64100967
2-propan-2-yl-N-[3-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 64101368
2-propyl-N-[2-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 64101536
2-propan-2-yl-N-[2-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 64101738
2-ethyl-2-methyl-N-(3,3,3-trifluoropropyl)oxan-4-amine
CID 64102494
2-propan-2-yl-N-(3,3,3-trifluoropropyl)oxan-4-amine
CID 64102696
2-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)oxan-4-amine
CID 64106293

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine?
The IUPAC name of N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine (CID 66206377) is N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine.
What is the SMILES notation for N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine?
The canonical SMILES for N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine is CCCC1CC(NC)(C(F)(F)F)CCO1.
What is the InChIKey of N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine?
The InChIKey is TZWBDFFTRBUUSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c1-3-4-8-7-9(14-2,5-6-15-8)10(11,12)13/h8,14H,3-7H2,1-2H3.
What are the key properties of N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine?
N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine has a molecular weight of 225.25 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-propyl-4-(trifluoromethyl)oxan-4-amine is sourced from PubChem (CID 66206377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).