1-cyclohexyl-2-(difluoromethoxy)ethanamine

C9H17F2NO — CID 84720011

IUPAC1-cyclohexyl-2-(difluoromethoxy)ethanamine
SMILESNC(COC(F)F)C1CCCCC1
InChIInChI=1S/C9H17F2NO/c10-9(11)13-6-8(12)7-4-2-1-3-5-7/h7-9H,1-6,12H2
InChIKeyYDUZJDPHEXAHTE-UHFFFAOYSA-N
MW193.24 g/mol
LogP2.13
Rot. Bonds4

About 1-cyclohexyl-2-(difluoromethoxy)ethanamine

1-cyclohexyl-2-(difluoromethoxy)ethanamine (PubChem CID 84720011) has the molecular formula C9H17F2NO and a molecular weight of 193.24 g/mol. Its IUPAC name is 1-cyclohexyl-2-(difluoromethoxy)ethanamine.

Molecular Properties

Compound Name1-cyclohexyl-2-(difluoromethoxy)ethanamine
PubChem CID84720011
Molecular FormulaC9H17F2NO
Molecular Weight193.24 g/mol
Exact Mass193.13
IUPAC Name1-cyclohexyl-2-(difluoromethoxy)ethanamine
SMILESNC(COC(F)F)C1CCCCC1
InChIInChI=1S/C9H17F2NO/c10-9(11)13-6-8(12)7-4-2-1-3-5-7/h7-9H,1-6,12H2
InChIKeyYDUZJDPHEXAHTE-UHFFFAOYSA-N
XLogP2.13
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.24
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclohexyl-2-(difluoromethoxy)ethanamine 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

3-Amino-4-cyclohexyl-1,1,1-trifluorobutan-2-ol
CID 4337613
2-(4,4-Difluorocyclohexyl)-2-ethoxyethan-1-amine hydrochloride
CID 155821550
1-Cyclohexyl-4,4-difluoro-5-propan-2-yloxypentan-2-amine
CID 54123882
3-Amino-3-cyclohexyl-1,1,1-trifluoropropan-2-ol
CID 69526783
(2S)-2-amino-3-(4,4-difluorocyclohexyl)propan-1-ol
CID 70639553
(2S)-2-amino-2-(4,4-difluorocyclohexyl)ethan-1-ol
CID 90239239
4-(3,3-Difluoropropoxymethyl)cyclohexan-1-amine
CID 118523703
(S)-2-amino-2-(4,4-difluorocyclohexyl)ethanol hydrochloride
CID 118536403
2-Amino-2-(4,4-difluorocyclohexyl)ethan-1-ol hydrochloride
CID 118536404
4-(3,3,3-Trifluoropropoxymethyl)cyclohexan-1-amine
CID 126566213
[(2S,3S)-1-cyclohexyl-4,4,4-trifluoro-3-hydroxybutan-2-yl]azanium
CID 2315330
(2S,3S)-3-amino-4-cyclohexyl-1,1,1-trifluorobutan-2-ol
CID 2315331

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(difluoromethoxy)ethanamine?
The IUPAC name of 1-cyclohexyl-2-(difluoromethoxy)ethanamine (CID 84720011) is 1-cyclohexyl-2-(difluoromethoxy)ethanamine.
What is the SMILES notation for 1-cyclohexyl-2-(difluoromethoxy)ethanamine?
The canonical SMILES for 1-cyclohexyl-2-(difluoromethoxy)ethanamine is NC(COC(F)F)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(difluoromethoxy)ethanamine?
The InChIKey is YDUZJDPHEXAHTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F2NO/c10-9(11)13-6-8(12)7-4-2-1-3-5-7/h7-9H,1-6,12H2.
What are the key properties of 1-cyclohexyl-2-(difluoromethoxy)ethanamine?
1-cyclohexyl-2-(difluoromethoxy)ethanamine has a molecular weight of 193.24 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(difluoromethoxy)ethanamine is sourced from PubChem (CID 84720011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).