3-cyclohexyloxy-2,2-difluoropropan-1-amine

C9H17F2NO — CID 165462190

IUPAC3-cyclohexyloxy-2,2-difluoropropan-1-amine
SMILESNCC(F)(F)COC1CCCCC1
InChIInChI=1S/C9H17F2NO/c10-9(11,6-12)7-13-8-4-2-1-3-5-8/h8H,1-7,12H2
InChIKeyRGRFPRZJVGHCKC-UHFFFAOYSA-N
MW193.24 g/mol
LogP1.93
Rot. Bonds4

About 3-cyclohexyloxy-2,2-difluoropropan-1-amine

3-cyclohexyloxy-2,2-difluoropropan-1-amine (PubChem CID 165462190) has the molecular formula C9H17F2NO and a molecular weight of 193.24 g/mol. Its IUPAC name is 3-cyclohexyloxy-2,2-difluoropropan-1-amine.

Molecular Properties

Compound Name3-cyclohexyloxy-2,2-difluoropropan-1-amine
PubChem CID165462190
Molecular FormulaC9H17F2NO
Molecular Weight193.24 g/mol
Exact Mass193.13
IUPAC Name3-cyclohexyloxy-2,2-difluoropropan-1-amine
SMILESNCC(F)(F)COC1CCCCC1
InChIInChI=1S/C9H17F2NO/c10-9(11,6-12)7-13-8-4-2-1-3-5-8/h8H,1-7,12H2
InChIKeyRGRFPRZJVGHCKC-UHFFFAOYSA-N
XLogP1.93
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 ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyloxy-2,2-difluoropropan-1-amine?
The IUPAC name of 3-cyclohexyloxy-2,2-difluoropropan-1-amine (CID 165462190) is 3-cyclohexyloxy-2,2-difluoropropan-1-amine.
What is the SMILES notation for 3-cyclohexyloxy-2,2-difluoropropan-1-amine?
The canonical SMILES for 3-cyclohexyloxy-2,2-difluoropropan-1-amine is NCC(F)(F)COC1CCCCC1.
What is the InChIKey of 3-cyclohexyloxy-2,2-difluoropropan-1-amine?
The InChIKey is RGRFPRZJVGHCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F2NO/c10-9(11,6-12)7-13-8-4-2-1-3-5-8/h8H,1-7,12H2.
What are the key properties of 3-cyclohexyloxy-2,2-difluoropropan-1-amine?
3-cyclohexyloxy-2,2-difluoropropan-1-amine has a molecular weight of 193.24 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyloxy-2,2-difluoropropan-1-amine is sourced from PubChem (CID 165462190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).