1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine

C10H19F2NO — CID 82005523

IUPAC1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine
SMILESCNCC1(OCC(F)F)CCCCC1
InChIInChI=1S/C10H19F2NO/c1-13-8-10(14-7-9(11)12)5-3-2-4-6-10/h9,13H,2-8H2,1H3
InChIKeyNDILHCPCYLAEFA-UHFFFAOYSA-N
MW207.26 g/mol
LogP2.19
Rot. Bonds5

About 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine

1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine (PubChem CID 82005523) has the molecular formula C10H19F2NO and a molecular weight of 207.26 g/mol. Its IUPAC name is 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine
PubChem CID82005523
Molecular FormulaC10H19F2NO
Molecular Weight207.26 g/mol
Exact Mass207.14
IUPAC Name1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine
SMILESCNCC1(OCC(F)F)CCCCC1
InChIInChI=1S/C10H19F2NO/c1-13-8-10(14-7-9(11)12)5-3-2-4-6-10/h9,13H,2-8H2,1H3
InChIKeyNDILHCPCYLAEFA-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine?
The IUPAC name of 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine (CID 82005523) is 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine is CNCC1(OCC(F)F)CCCCC1.
What is the InChIKey of 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine?
The InChIKey is NDILHCPCYLAEFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2NO/c1-13-8-10(14-7-9(11)12)5-3-2-4-6-10/h9,13H,2-8H2,1H3.
What are the key properties of 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine?
1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine has a molecular weight of 207.26 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2,2-difluoroethoxy)cyclohexyl]-N-methylmethanamine is sourced from PubChem (CID 82005523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).