(4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine

C15H27F2N — CID 105154323

IUPAC(4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine
SMILESCC1CC(C)CC(C(N)C2CCC(F)(F)CC2)C1
InChIInChI=1S/C15H27F2N/c1-10-7-11(2)9-13(8-10)14(18)12-3-5-15(16,17)6-4-12/h10-14H,3-9,18H2,1-2H3
InChIKeyOGSUTPJINYALCS-UHFFFAOYSA-N
MW259.38 g/mol
LogP4.21
Rot. Bonds2

About (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine

(4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine (PubChem CID 105154323) has the molecular formula C15H27F2N and a molecular weight of 259.38 g/mol. Its IUPAC name is (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine.

Molecular Properties

Compound Name(4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine
PubChem CID105154323
Molecular FormulaC15H27F2N
Molecular Weight259.38 g/mol
Exact Mass259.21
IUPAC Name(4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine
SMILESCC1CC(C)CC(C(N)C2CCC(F)(F)CC2)C1
InChIInChI=1S/C15H27F2N/c1-10-7-11(2)9-13(8-10)14(18)12-3-5-15(16,17)6-4-12/h10-14H,3-9,18H2,1-2H3
InChIKeyOGSUTPJINYALCS-UHFFFAOYSA-N
XLogP4.21
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine 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

(4-tert-butylcyclohexyl)-(3,5-dimethylcyclohexyl)methanamine
CID 65402362
cyclopentyl-(3,3-difluorocyclopentyl)methanamine
CID 130484946
(3,5-dimethylcyclohexyl)-(4-propylcyclohexyl)methanamine
CID 65424912
1,1-difluoro-4-methylcyclohexane;methanamine
CID 144779644
(2,2-dimethylcyclohexyl)-(3,5-dimethylcyclohexyl)methanamine
CID 107189180
1-(4,4-difluorocyclohexyl)-2,2-dimethylpropan-1-amine
CID 105146065
methyl (2R)-2-amino-2-(4,4-difluorocyclohexyl)acetate
CID 71742057
(3,5-dimethylcyclohexyl)-(3-ethylcyclopentyl)methanamine
CID 65411202
1,1-difluoro-4-(3-methylbutan-2-yl)cyclohexane
CID 134252083
2-(4,4-difluorocyclohexyl)-1-methoxypropan-1-ol
CID 90710421
1-(4,4-difluorocyclohexyl)ethylhydrazine
CID 105282609
azane;1,1-difluoro-4-methylcyclohexane;hydrochloride
CID 126721446

Frequently Asked Questions

What is the IUPAC name of (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine?
The IUPAC name of (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine (CID 105154323) is (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine.
What is the SMILES notation for (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine?
The canonical SMILES for (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine is CC1CC(C)CC(C(N)C2CCC(F)(F)CC2)C1.
What is the InChIKey of (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine?
The InChIKey is OGSUTPJINYALCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27F2N/c1-10-7-11(2)9-13(8-10)14(18)12-3-5-15(16,17)6-4-12/h10-14H,3-9,18H2,1-2H3.
What are the key properties of (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine?
(4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine has a molecular weight of 259.38 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4,4-difluorocyclohexyl)-(3,5-dimethylcyclohexyl)methanamine is sourced from PubChem (CID 105154323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).