4-fluoro-6-methylcyclohexen-1-amine

C7H12FN — CID 118629867

IUPAC4-fluoro-6-methylcyclohexen-1-amine
SMILESCC1CC(F)CC=C1N
InChIInChI=1S/C7H12FN/c1-5-4-6(8)2-3-7(5)9/h3,5-6H,2,4,9H2,1H3
InChIKeyRFNZWCKQSVIUAM-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.60
Rot. Bonds

About 4-fluoro-6-methylcyclohexen-1-amine

4-fluoro-6-methylcyclohexen-1-amine (PubChem CID 118629867) has the molecular formula C7H12FN and a molecular weight of 129.18 g/mol. Its IUPAC name is 4-fluoro-6-methylcyclohexen-1-amine.

Molecular Properties

Compound Name4-fluoro-6-methylcyclohexen-1-amine
PubChem CID118629867
Molecular FormulaC7H12FN
Molecular Weight129.18 g/mol
Exact Mass129.10
IUPAC Name4-fluoro-6-methylcyclohexen-1-amine
SMILESCC1CC(F)CC=C1N
InChIInChI=1S/C7H12FN/c1-5-4-6(8)2-3-7(5)9/h3,5-6H,2,4,9H2,1H3
InChIKeyRFNZWCKQSVIUAM-UHFFFAOYSA-N
XLogP1.60
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Fluoro-4-methylcyclohexen-1-amine
CID 88993024
4-Methyl-6-(trifluoromethyl)cyclohexen-1-amine
CID 89038480
6-Methyl-4-(trifluoromethyl)cyclohexa-1,3-dien-1-amine
CID 89074118
4-(Trifluoromethyl)cyclohexen-1-amine
CID 89074199
6-Fluorocyclohexen-1-amine
CID 89217754
4-Fluorocyclohexen-1-amine
CID 89217760
(6R)-4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-6-methylcyclohexa-1,3-dien-1-amine
CID 89555619
(6R)-3-fluoro-6-methylcyclohexa-1,3-dien-1-amine
CID 89555692
(3R,6S)-6-fluoro-3-methylcyclohexen-1-amine
CID 118069798
3-Fluoro-5-methylcyclohexa-1,3-dien-1-amine
CID 118242563
5-(1,1-Difluoroethyl)-3-fluorocyclohexen-1-amine
CID 134409095
4-Fluoro-5-methylcyclohexa-1,3-dien-1-amine
CID 137484487

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-methylcyclohexen-1-amine?
The IUPAC name of 4-fluoro-6-methylcyclohexen-1-amine (CID 118629867) is 4-fluoro-6-methylcyclohexen-1-amine.
What is the SMILES notation for 4-fluoro-6-methylcyclohexen-1-amine?
The canonical SMILES for 4-fluoro-6-methylcyclohexen-1-amine is CC1CC(F)CC=C1N.
What is the InChIKey of 4-fluoro-6-methylcyclohexen-1-amine?
The InChIKey is RFNZWCKQSVIUAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FN/c1-5-4-6(8)2-3-7(5)9/h3,5-6H,2,4,9H2,1H3.
What are the key properties of 4-fluoro-6-methylcyclohexen-1-amine?
4-fluoro-6-methylcyclohexen-1-amine has a molecular weight of 129.18 g/mol, XLogP of 1.60, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-methylcyclohexen-1-amine is sourced from PubChem (CID 118629867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).