1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol

C15H29NO — CID 164681336

IUPAC1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol
SMILESCC(O)C1CCCCC1NCC1CCCCC1
InChIInChI=1S/C15H29NO/c1-12(17)14-9-5-6-10-15(14)16-11-13-7-3-2-4-8-13/h12-17H,2-11H2,1H3
InChIKeyAVBVSNXRYSRRND-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.10
Rot. Bonds4

About 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol

1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol (PubChem CID 164681336) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol.

Molecular Properties

Compound Name1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol
PubChem CID164681336
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol
SMILESCC(O)C1CCCCC1NCC1CCCCC1
InChIInChI=1S/C15H29NO/c1-12(17)14-9-5-6-10-15(14)16-11-13-7-3-2-4-8-13/h12-17H,2-11H2,1H3
InChIKeyAVBVSNXRYSRRND-UHFFFAOYSA-N
XLogP3.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol?
The IUPAC name of 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol (CID 164681336) is 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol.
What is the SMILES notation for 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol?
The canonical SMILES for 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol is CC(O)C1CCCCC1NCC1CCCCC1.
What is the InChIKey of 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol?
The InChIKey is AVBVSNXRYSRRND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12(17)14-9-5-6-10-15(14)16-11-13-7-3-2-4-8-13/h12-17H,2-11H2,1H3.
What are the key properties of 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol?
1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol has a molecular weight of 239.40 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclohexylmethylamino)cyclohexyl]ethanol is sourced from PubChem (CID 164681336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).