N-(3,3,3-trifluoropropyl)oxolan-3-amine

C7H12F3NO — CID 63335110

IUPACN-(3,3,3-trifluoropropyl)oxolan-3-amine
SMILESFC(F)(F)CCNC1CCOC1
InChIInChI=1S/C7H12F3NO/c8-7(9,10)2-3-11-6-1-4-12-5-6/h6,11H,1-5H2
InChIKeyYGLVMLGECYIONQ-UHFFFAOYSA-N
MW183.17 g/mol
LogP1.32
Rot. Bonds3

About N-(3,3,3-trifluoropropyl)oxolan-3-amine

N-(3,3,3-trifluoropropyl)oxolan-3-amine (PubChem CID 63335110) has the molecular formula C7H12F3NO and a molecular weight of 183.17 g/mol. Its IUPAC name is N-(3,3,3-trifluoropropyl)oxolan-3-amine.

Molecular Properties

Compound NameN-(3,3,3-trifluoropropyl)oxolan-3-amine
PubChem CID63335110
Molecular FormulaC7H12F3NO
Molecular Weight183.17 g/mol
Exact Mass183.09
IUPAC NameN-(3,3,3-trifluoropropyl)oxolan-3-amine
SMILESFC(F)(F)CCNC1CCOC1
InChIInChI=1S/C7H12F3NO/c8-7(9,10)2-3-11-6-1-4-12-5-6/h6,11H,1-5H2
InChIKeyYGLVMLGECYIONQ-UHFFFAOYSA-N
XLogP1.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4,4-dimethylpentyl)oxolan-3-amine
CID 115689448
N-(2-cyclopentylethyl)oxolan-3-amine
CID 63335422
N-(4-iodobutyl)oxolan-3-amine
CID 106844615
N'-(oxolan-3-yl)propane-1,3-diamine
CID 63335365
N-(2-methoxyethyl)oxolan-3-amine
CID 63331660
methanidyl-[2-(oxolan-3-ylamino)ethyl]azanium
CID 88554159
3,3,3-trifluoro-N-[2-(oxolan-3-yl)ethyl]propan-1-amine
CID 102672424
N-(3,3,3-trifluoropropyl)-1-oxa-9-thiaspiro[5.5]undecan-4-amine
CID 79903035
N-(oxolan-3-yl)-N'-phenylethane-1,2-diamine
CID 115693261
N-[2-(1-methylpiperidin-4-yl)ethyl]oxolan-3-amine
CID 115689075
N-(3,3,3-trifluoropropyl)pyrrolidin-3-amine
CID 79741324
N-(4-methoxybutyl)oxolan-3-amine
CID 63335646

Frequently Asked Questions

What is the IUPAC name of N-(3,3,3-trifluoropropyl)oxolan-3-amine?
The IUPAC name of N-(3,3,3-trifluoropropyl)oxolan-3-amine (CID 63335110) is N-(3,3,3-trifluoropropyl)oxolan-3-amine.
What is the SMILES notation for N-(3,3,3-trifluoropropyl)oxolan-3-amine?
The canonical SMILES for N-(3,3,3-trifluoropropyl)oxolan-3-amine is FC(F)(F)CCNC1CCOC1.
What is the InChIKey of N-(3,3,3-trifluoropropyl)oxolan-3-amine?
The InChIKey is YGLVMLGECYIONQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3NO/c8-7(9,10)2-3-11-6-1-4-12-5-6/h6,11H,1-5H2.
What are the key properties of N-(3,3,3-trifluoropropyl)oxolan-3-amine?
N-(3,3,3-trifluoropropyl)oxolan-3-amine has a molecular weight of 183.17 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3,3-trifluoropropyl)oxolan-3-amine is sourced from PubChem (CID 63335110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).