2-fluoro-2,3-dimethylhexan-1-amine

C8H18FN — CID 107889779

IUPAC2-fluoro-2,3-dimethylhexan-1-amine
SMILESCCCC(C)C(C)(F)CN
InChIInChI=1S/C8H18FN/c1-4-5-7(2)8(3,9)6-10/h7H,4-6,10H2,1-3H3
InChIKeyJVKYBFFSFZOCGX-UHFFFAOYSA-N
MW147.24 g/mol
LogP2.11
Rot. Bonds4

About 2-fluoro-2,3-dimethylhexan-1-amine

2-fluoro-2,3-dimethylhexan-1-amine (PubChem CID 107889779) has the molecular formula C8H18FN and a molecular weight of 147.24 g/mol. Its IUPAC name is 2-fluoro-2,3-dimethylhexan-1-amine.

Molecular Properties

Compound Name2-fluoro-2,3-dimethylhexan-1-amine
PubChem CID107889779
Molecular FormulaC8H18FN
Molecular Weight147.24 g/mol
Exact Mass147.14
IUPAC Name2-fluoro-2,3-dimethylhexan-1-amine
SMILESCCCC(C)C(C)(F)CN
InChIInChI=1S/C8H18FN/c1-4-5-7(2)8(3,9)6-10/h7H,4-6,10H2,1-3H3
InChIKeyJVKYBFFSFZOCGX-UHFFFAOYSA-N
XLogP2.11
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.24
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-Ethylhexan-1-amine
CID 20328494
3,4-Dimethylhexan-1-amine hydrochloride
CID 165946625
7-Fluoro-3,7-dimethyloctan-1-amine
CID 154715479
3,4-Dimethylhexan-1-amine
CID 19083263
2-Butyl-2-fluorohexan-1-amine
CID 20067365
(2S)-2-ethyl-4-methylpentan-1-amine
CID 55290279
[3-(Propan-2-yl)cyclobutyl]methanamine
CID 65017151
3-Fluoro-3-methylhexan-1-amine
CID 84762375
(2S,4S)-7-fluoro-4-methylheptan-2-amine
CID 87202748
7-Fluoro-4-methylheptan-2-amine
CID 87202776
6-Fluoro-4-methylheptan-2-amine
CID 87579020
1-Fluoro-3-methyl-2-propan-2-ylbutan-1-amine
CID 87858836

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2,3-dimethylhexan-1-amine?
The IUPAC name of 2-fluoro-2,3-dimethylhexan-1-amine (CID 107889779) is 2-fluoro-2,3-dimethylhexan-1-amine.
What is the SMILES notation for 2-fluoro-2,3-dimethylhexan-1-amine?
The canonical SMILES for 2-fluoro-2,3-dimethylhexan-1-amine is CCCC(C)C(C)(F)CN.
What is the InChIKey of 2-fluoro-2,3-dimethylhexan-1-amine?
The InChIKey is JVKYBFFSFZOCGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18FN/c1-4-5-7(2)8(3,9)6-10/h7H,4-6,10H2,1-3H3.
What are the key properties of 2-fluoro-2,3-dimethylhexan-1-amine?
2-fluoro-2,3-dimethylhexan-1-amine has a molecular weight of 147.24 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2,3-dimethylhexan-1-amine is sourced from PubChem (CID 107889779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).