3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine

C8H15F2NO — CID 82718200

IUPAC3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine
SMILESCCNC1(C(F)F)CCOC1C
InChIInChI=1S/C8H15F2NO/c1-3-11-8(7(9)10)4-5-12-6(8)2/h6-7,11H,3-5H2,1-2H3
InChIKeyGYTFBUFKCUQIQX-UHFFFAOYSA-N
MW179.21 g/mol
LogP1.41
Rot. Bonds3

About 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine

3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine (PubChem CID 82718200) has the molecular formula C8H15F2NO and a molecular weight of 179.21 g/mol. Its IUPAC name is 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine.

Molecular Properties

Compound Name3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine
PubChem CID82718200
Molecular FormulaC8H15F2NO
Molecular Weight179.21 g/mol
Exact Mass179.11
IUPAC Name3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine
SMILESCCNC1(C(F)F)CCOC1C
InChIInChI=1S/C8H15F2NO/c1-3-11-8(7(9)10)4-5-12-6(8)2/h6-7,11H,3-5H2,1-2H3
InChIKeyGYTFBUFKCUQIQX-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.21
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine 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-Methyl-3,3-bis(2,2,2-trifluoroethyl)morpholine
CID 150129717
2-(Difluoromethyl)-2-(propan-2-yloxymethyl)pyrrolidine
CID 172328782
5,5-Diethyl-2-(trifluoromethyl)morpholine
CID 63901507
N-ethyl-3-(trifluoromethyl)oxolan-3-amine
CID 66204966
N-propyl-3-(trifluoromethyl)oxolan-3-amine
CID 66206611
2,2,2-trifluoro-N-[(2-methyloxolan-3-yl)methyl]ethanamine
CID 79760042
N-ethyl-3-methyl-1-(1,1,1-trifluoropropan-2-yloxy)pentan-2-amine
CID 80447222
3-methyl-N-propyl-1-(1,1,1-trifluoropropan-2-yloxy)pentan-2-amine
CID 80447317
3-(difluoromethyl)-N-ethyloxolan-3-amine
CID 80604448
3-(difluoromethyl)-N-propyloxolan-3-amine
CID 80605414
2,2,2-trifluoro-N-[(3-methyloxolan-2-yl)methyl]ethanamine
CID 81575581
3-(difluoromethyl)-2-methyl-N-propyloxolan-3-amine
CID 82717350

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine?
The IUPAC name of 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine (CID 82718200) is 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine.
What is the SMILES notation for 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine?
The canonical SMILES for 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine is CCNC1(C(F)F)CCOC1C.
What is the InChIKey of 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine?
The InChIKey is GYTFBUFKCUQIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO/c1-3-11-8(7(9)10)4-5-12-6(8)2/h6-7,11H,3-5H2,1-2H3.
What are the key properties of 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine?
3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine has a molecular weight of 179.21 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-N-ethyl-2-methyloxolan-3-amine is sourced from PubChem (CID 82718200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).