2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine

C11H22F3N — CID 166766950

IUPAC2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine
SMILESCC(C)[C@@H](NC(C)(C)C(C)C)C(F)(F)F
InChIInChI=1S/C11H22F3N/c1-7(2)9(11(12,13)14)15-10(5,6)8(3)4/h7-9,15H,1-6H3/t9-/m1/s1
InChIKeyVKZILXQBNSRRGK-SECBINFHSA-N
MW225.30 g/mol
LogP3.60
Rot. Bonds4

About 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine

2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine (PubChem CID 166766950) has the molecular formula C11H22F3N and a molecular weight of 225.30 g/mol. Its IUPAC name is 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine
PubChem CID166766950
Molecular FormulaC11H22F3N
Molecular Weight225.30 g/mol
Exact Mass225.17
IUPAC Name2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine
SMILESCC(C)[C@@H](NC(C)(C)C(C)C)C(F)(F)F
InChIInChI=1S/C11H22F3N/c1-7(2)9(11(12,13)14)15-10(5,6)8(3)4/h7-9,15H,1-6H3/t9-/m1/s1
InChIKeyVKZILXQBNSRRGK-SECBINFHSA-N
XLogP3.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-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-chloro-2-fluoro-3-methylbutane
CID 88897527
2-methyl-N-(1,1,1-trifluoro-3-methylbutan-2-yl)propanamide
CID 175635601
ethane;1,1,1-trifluoro-2-methylpropane
CID 155727070
(2R)-1,1,1-trifluoro-2,3,3-trimethylbutane
CID 89330096
(3R)-2,2-dimethyl-3-[(2S)-1,1,1-trifluoropropan-2-yl]oxybutane
CID 168729792
N-tert-butyl-2,3-dimethylbutan-2-amine
CID 59551528
1-[2,3-dimethyl-3-[(1,1,1-trifluoro-3-methylbutan-2-yl)amino]butan-2-yl]-N-[(Z)-4-fluoro-2,3,3,6-tetramethylhept-4-en-2-yl]cyclopropan-1-amine
CID 170263361
N-(2,3-dimethylbutan-2-yl)-1-phenylethane-1,2-diamine
CID 146442831
1,1,1-trifluoro-2-methyl-N-propan-2-ylpropan-2-amine
CID 20782611
3,3-difluoro-2,2,4-trimethylpentane
CID 88950288
methane;1,1,1-trifluoro-2,3-dimethylbutane
CID 157393455
1,1,1,3,3,3-hexafluoro-2-methylpropane
CID 158463707

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine?
The IUPAC name of 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine (CID 166766950) is 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine.
What is the SMILES notation for 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine?
The canonical SMILES for 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine is CC(C)[C@@H](NC(C)(C)C(C)C)C(F)(F)F.
What is the InChIKey of 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine?
The InChIKey is VKZILXQBNSRRGK-SECBINFHSA-N. The full InChI is InChI=1S/C11H22F3N/c1-7(2)9(11(12,13)14)15-10(5,6)8(3)4/h7-9,15H,1-6H3/t9-/m1/s1.
What are the key properties of 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine?
2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine has a molecular weight of 225.30 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[(2R)-1,1,1-trifluoro-3-methylbutan-2-yl]butan-2-amine is sourced from PubChem (CID 166766950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).