N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine

C11H21F2N — CID 130183225

IUPACN-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine
SMILESC=CNCC(F)(F)CCCC(C)(C)C
InChIInChI=1S/C11H21F2N/c1-5-14-9-11(12,13)8-6-7-10(2,3)4/h5,14H,1,6-9H2,2-4H3
InChIKeyPTDYTNRPEUEKCC-UHFFFAOYSA-N
MW205.29 g/mol
LogP3.57
Rot. Bonds6

About N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine

N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine (PubChem CID 130183225) has the molecular formula C11H21F2N and a molecular weight of 205.29 g/mol. Its IUPAC name is N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine.

Molecular Properties

Compound NameN-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine
PubChem CID130183225
Molecular FormulaC11H21F2N
Molecular Weight205.29 g/mol
Exact Mass205.16
IUPAC NameN-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine
SMILESC=CNCC(F)(F)CCCC(C)(C)C
InChIInChI=1S/C11H21F2N/c1-5-14-9-11(12,13)8-6-7-10(2,3)4/h5,14H,1,6-9H2,2-4H3
InChIKeyPTDYTNRPEUEKCC-UHFFFAOYSA-N
XLogP3.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethenyl-2,2,4,4-tetrafluoropentan-1-amine
CID 158174051
molecular hydrogen;2,2,6,6-tetramethylheptane
CID 169194475
barium(2+);hydride;2,2,6,6-tetramethylheptane
CID 173027218
2,2-dimethylhexane;tris(prop-1-ene)
CID 160899116
2-(4,4-dimethylpentyl)-N'-ethenyl-2-fluoro-N-[2-[(E)-2-phenylethenyl]cyclopropyl]butane-1,4-diamine
CID 138711219
1,1,1-trifluoro-20,20-dimethylhenicosane
CID 152547440
1-(5,5-dimethylhexyl)-2-methyl-3-prop-2-enylguanidine
CID 110982625
1-ethenoxy-4,4-dimethylpentane
CID 58671996
7-fluoro-7-methyloct-1-ene
CID 87159398
ethane;2,2,6,6-tetramethylheptane;tritium monohydride
CID 158881033
N-(6,6-dimethylheptyl)formamide
CID 166796466
argon;ethane;1,1,1-trifluoro-2,2-dimethylpropane;1,1,1-trifluoro-2,2,6,6-tetramethylheptane
CID 167697447

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine?
The IUPAC name of N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine (CID 130183225) is N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine.
What is the SMILES notation for N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine?
The canonical SMILES for N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine is C=CNCC(F)(F)CCCC(C)(C)C.
What is the InChIKey of N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine?
The InChIKey is PTDYTNRPEUEKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F2N/c1-5-14-9-11(12,13)8-6-7-10(2,3)4/h5,14H,1,6-9H2,2-4H3.
What are the key properties of N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine?
N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine has a molecular weight of 205.29 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2,2-difluoro-6,6-dimethylheptan-1-amine is sourced from PubChem (CID 130183225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).