4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine

C8H17F2N — CID 170950191

IUPAC4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine
SMILESCN(C)CCC(C)(C)C(F)F
InChIInChI=1S/C8H17F2N/c1-8(2,7(9)10)5-6-11(3)4/h7H,5-6H2,1-4H3
InChIKeyQAHNDJAVKRRVFW-UHFFFAOYSA-N
MW165.23 g/mol
LogP2.23
Rot. Bonds4

About 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine

4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine (PubChem CID 170950191) has the molecular formula C8H17F2N and a molecular weight of 165.23 g/mol. Its IUPAC name is 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine.

Molecular Properties

Compound Name4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine
PubChem CID170950191
Molecular FormulaC8H17F2N
Molecular Weight165.23 g/mol
Exact Mass165.13
IUPAC Name4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine
SMILESCN(C)CCC(C)(C)C(F)F
InChIInChI=1S/C8H17F2N/c1-8(2,7(9)10)5-6-11(3)4/h7H,5-6H2,1-4H3
InChIKeyQAHNDJAVKRRVFW-UHFFFAOYSA-N
XLogP2.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.23
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[2-(dimethylamino)ethyl]-N,N,N',N',3-pentamethylpentane-1,5-diamine
CID 89049269
N,N,N',N',3,3-hexamethylpentane-1,5-diamine
CID 143746016
3,3-difluoro-N,N,4,4-tetramethylpentan-1-amine
CID 164750438
1-N,1-N,3,4-tetramethylpentane-1,3-diamine
CID 57171035
4-(dimethylamino)-2-methylbutan-2-ol;zirconium
CID 58881629
3,3-difluoro-N,N-dimethylbutan-1-amine;ethane;N,N,N'-trimethyl-N'-propan-2-ylethane-1,2-diamine
CID 172563999
N',N',2,2-tetramethylbutane-1,4-diamine
CID 65250173
3-ethyl-3-fluoro-N,N,4-trimethylpentan-1-amine
CID 163258441
3-fluoro-N,N-dimethylbutan-1-amine
CID 142449569
6-N,6-N-dichloro-3,3-difluoro-1-N,1-N,6-trimethylheptane-1,6-diamine
CID 162564095
5-(dimethylamino)-3,3-dimethylpentanamide;ethane
CID 166075675
4-(dimethylamino)-2,2-bis[2-(dimethylamino)ethyl]butane-1,1,1-triol
CID 88768729

Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine?
The IUPAC name of 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine (CID 170950191) is 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine.
What is the SMILES notation for 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine?
The canonical SMILES for 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine is CN(C)CCC(C)(C)C(F)F.
What is the InChIKey of 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine?
The InChIKey is QAHNDJAVKRRVFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17F2N/c1-8(2,7(9)10)5-6-11(3)4/h7H,5-6H2,1-4H3.
What are the key properties of 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine?
4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine has a molecular weight of 165.23 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-N,N,3,3-tetramethylbutan-1-amine is sourced from PubChem (CID 170950191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).