N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine

C10H21F2N — CID 129150648

IUPACN-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine
SMILESCC(C)(C)N(CC(F)F)C(C)(C)C
InChIInChI=1S/C10H21F2N/c1-9(2,3)13(7-8(11)12)10(4,5)6/h8H,7H2,1-6H3
InChIKeyTZMBLILGQYEAOQ-UHFFFAOYSA-N
MW193.28 g/mol
LogP3.15
Rot. Bonds2

About N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine

N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine (PubChem CID 129150648) has the molecular formula C10H21F2N and a molecular weight of 193.28 g/mol. Its IUPAC name is N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine
PubChem CID129150648
Molecular FormulaC10H21F2N
Molecular Weight193.28 g/mol
Exact Mass193.16
IUPAC NameN-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine
SMILESCC(C)(C)N(CC(F)F)C(C)(C)C
InChIInChI=1S/C10H21F2N/c1-9(2,3)13(7-8(11)12)10(4,5)6/h8H,7H2,1-6H3
InChIKeyTZMBLILGQYEAOQ-UHFFFAOYSA-N
XLogP3.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.28
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-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

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine?
The IUPAC name of N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine (CID 129150648) is N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine.
What is the SMILES notation for N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine?
The canonical SMILES for N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine is CC(C)(C)N(CC(F)F)C(C)(C)C.
What is the InChIKey of N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine?
The InChIKey is TZMBLILGQYEAOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21F2N/c1-9(2,3)13(7-8(11)12)10(4,5)6/h8H,7H2,1-6H3.
What are the key properties of N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine?
N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine has a molecular weight of 193.28 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N-(2,2-difluoroethyl)-2-methylpropan-2-amine is sourced from PubChem (CID 129150648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).