N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine

C14H25F3N2O — CID 62255857

IUPACN-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine
SMILESCC(C)N(CC(F)(F)F)CC1(CNC2CC2)CCOC1
InChIInChI=1S/C14H25F3N2O/c1-11(2)19(9-14(15,16)17)8-13(5-6-20-10-13)7-18-12-3-4-12/h11-12,18H,3-10H2,1-2H3
InChIKeyRZVFCJADDNWPMJ-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.42
Rot. Bonds7

About N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine

N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine (PubChem CID 62255857) has the molecular formula C14H25F3N2O and a molecular weight of 294.36 g/mol. Its IUPAC name is N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine
PubChem CID62255857
Molecular FormulaC14H25F3N2O
Molecular Weight294.36 g/mol
Exact Mass294.19
IUPAC NameN-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine
SMILESCC(C)N(CC(F)(F)F)CC1(CNC2CC2)CCOC1
InChIInChI=1S/C14H25F3N2O/c1-11(2)19(9-14(15,16)17)8-13(5-6-20-10-13)7-18-12-3-4-12/h11-12,18H,3-10H2,1-2H3
InChIKeyRZVFCJADDNWPMJ-UHFFFAOYSA-N
XLogP2.42
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine with MolForge

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Related Compounds

N-[[3-(ethylaminomethyl)oxolan-3-yl]methyl]-2,2,2-trifluoro-N-methylethanamine
CID 55051447
2-methyl-N-[[3-[[methyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]propan-2-amine
CID 55051448
N-ethyl-N-[[3-(ethylaminomethyl)oxolan-3-yl]methyl]-2,2,2-trifluoroethanamine
CID 55055941
N-[[3-(aminomethyl)oxolan-3-yl]methyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine
CID 55055990
N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine
CID 55056037
N-[[3-(aminomethyl)oxolan-3-yl]methyl]-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 55056230
N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 55056278
N-[[3-(aminomethyl)oxolan-3-yl]methyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 55056514
N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 55056562
N'-cyclopropyl-N-(oxolan-3-ylmethyl)-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 55089876
N-(oxolan-3-ylmethyl)-N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 55090261
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 61491010

Frequently Asked Questions

What is the IUPAC name of N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine (CID 62255857) is N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine is CC(C)N(CC(F)(F)F)CC1(CNC2CC2)CCOC1.
What is the InChIKey of N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine?
The InChIKey is RZVFCJADDNWPMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O/c1-11(2)19(9-14(15,16)17)8-13(5-6-20-10-13)7-18-12-3-4-12/h11-12,18H,3-10H2,1-2H3.
What are the key properties of N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine?
N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine has a molecular weight of 294.36 g/mol, XLogP of 2.42, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62255857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).