2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine

C15H25F3N2O — CID 62426254

IUPAC2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine
SMILESCC(C)CNCc1occc1CN(CC(F)(F)F)C(C)C
InChIInChI=1S/C15H25F3N2O/c1-11(2)7-19-8-14-13(5-6-21-14)9-20(12(3)4)10-15(16,17)18/h5-6,11-12,19H,7-10H2,1-4H3
InChIKeyBHZIGGRZUCGATP-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.80
Rot. Bonds8

About 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine

2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine (PubChem CID 62426254) has the molecular formula C15H25F3N2O and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine
PubChem CID62426254
Molecular FormulaC15H25F3N2O
Molecular Weight306.37 g/mol
Exact Mass306.19
IUPAC Name2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine
SMILESCC(C)CNCc1occc1CN(CC(F)(F)F)C(C)C
InChIInChI=1S/C15H25F3N2O/c1-11(2)7-19-8-14-13(5-6-21-14)9-20(12(3)4)10-15(16,17)18/h5-6,11-12,19H,7-10H2,1-4H3
InChIKeyBHZIGGRZUCGATP-UHFFFAOYSA-N
XLogP3.80
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine with MolForge

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Related Compounds

2-methyl-N-[[3-(2,2,2-trifluoroethoxymethyl)furan-2-yl]methyl]propan-1-amine
CID 62445604
N-methyl-N-[[2-[(2-methylpropylamino)methyl]furan-3-yl]methyl]cyclopentanamine
CID 62419680
2-methyl-N-[[3-[[methyl(2-methylsulfanylethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine
CID 112665532
2-methyl-N-[[2-(2,2,2-trifluoroethoxymethyl)furan-3-yl]methyl]propan-1-amine
CID 62445215
2,2,2-trifluoro-N-methyl-N-[[2-(methylaminomethyl)furan-3-yl]methyl]ethanamine
CID 62428704
2-methyl-N-[(3-methylfuran-2-yl)methyl]propan-1-amine
CID 60985208
2-methyl-N-[[3-[[propan-2-yl(propyl)amino]methyl]furan-2-yl]methyl]propan-2-amine
CID 55075072
N-[[2-(ethylaminomethyl)furan-3-yl]methyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine
CID 55073867
N,3-dimethyl-N-[[3-[(2-methylpropylamino)methyl]furan-2-yl]methyl]butan-2-amine
CID 62432117
2-methyl-N-[[3-(prop-2-enoxymethyl)furan-2-yl]methyl]propan-1-amine
CID 62441488
4-fluoro-N-methyl-N-[[3-[(2-methylpropylamino)methyl]furan-2-yl]methyl]aniline
CID 62435869
2-methyl-N-[[3-(4-methylpentoxymethyl)furan-2-yl]methyl]propan-1-amine
CID 62456618

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine (CID 62426254) is 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine is CC(C)CNCc1occc1CN(CC(F)(F)F)C(C)C.
What is the InChIKey of 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine?
The InChIKey is BHZIGGRZUCGATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2O/c1-11(2)7-19-8-14-13(5-6-21-14)9-20(12(3)4)10-15(16,17)18/h5-6,11-12,19H,7-10H2,1-4H3.
What are the key properties of 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine?
2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine has a molecular weight of 306.37 g/mol, XLogP of 3.80, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]furan-2-yl]methyl]propan-1-amine is sourced from PubChem (CID 62426254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).