3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine

C10H19F2N — CID 178026396

IUPAC3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine
SMILESCC(C)CCN(C)C1CC(F)(F)C1
InChIInChI=1S/C10H19F2N/c1-8(2)4-5-13(3)9-6-10(11,12)7-9/h8-9H,4-7H2,1-3H3
InChIKeyIJVDIHWJHHFTJF-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.76
Rot. Bonds4

About 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine

3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine (PubChem CID 178026396) has the molecular formula C10H19F2N and a molecular weight of 191.26 g/mol. Its IUPAC name is 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine
PubChem CID178026396
Molecular FormulaC10H19F2N
Molecular Weight191.26 g/mol
Exact Mass191.15
IUPAC Name3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine
SMILESCC(C)CCN(C)C1CC(F)(F)C1
InChIInChI=1S/C10H19F2N/c1-8(2)4-5-13(3)9-6-10(11,12)7-9/h8-9H,4-7H2,1-3H3
InChIKeyIJVDIHWJHHFTJF-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-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

Triethyl-(2,2,3,3,4,4-hexafluorocyclobutyl)azanium
CID 57026965
1,1-difluoro-2-methyl-N,N-di(propan-2-yl)propan-1-amine
CID 135082782
N-(2,2-difluoroethyl)-N,3-dimethylbutan-1-amine
CID 20811852
2-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 89290934
1-Tert-butyl-3-(1,1-difluoroethyl)azetidine
CID 90450827
1,1,1-trifluoro-N,N,4-trimethylpentan-2-amine
CID 90999431
N,3-dimethyl-N-(2,2,2-trifluoroethyl)butan-1-amine
CID 115257908
1-(1,1,1-Trifluoro-3-methylbutan-2-yl)pyrrolidine
CID 117706286
3-(1-Fluoroethyl)-1-propan-2-ylazetidine
CID 117804153
4,4,4-trifluoro-N,3-dimethyl-N-(2-methylpropyl)butan-1-amine
CID 117937206
4,4,4-trifluoro-N,2,3-trimethyl-N-(2-methylpropyl)butan-1-amine
CID 117937245
N,3-dimethyl-N-(2,2,2-trifluoroethyl)butan-2-amine
CID 118941478

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine?
The IUPAC name of 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine (CID 178026396) is 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine.
What is the SMILES notation for 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine?
The canonical SMILES for 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine is CC(C)CCN(C)C1CC(F)(F)C1.
What is the InChIKey of 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine?
The InChIKey is IJVDIHWJHHFTJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2N/c1-8(2)4-5-13(3)9-6-10(11,12)7-9/h8-9H,4-7H2,1-3H3.
What are the key properties of 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine?
3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine has a molecular weight of 191.26 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-N-methyl-N-(3-methylbutyl)cyclobutan-1-amine is sourced from PubChem (CID 178026396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).