[1-(cyclohexylamino)-4-ethylcyclohexyl]methanol

C15H29NO — CID 61046557

IUPAC[1-(cyclohexylamino)-4-ethylcyclohexyl]methanol
SMILESCCC1CCC(CO)(NC2CCCCC2)CC1
InChIInChI=1S/C15H29NO/c1-2-13-8-10-15(12-17,11-9-13)16-14-6-4-3-5-7-14/h13-14,16-17H,2-12H2,1H3
InChIKeyWGPMGJPKFQTTJG-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.24
Rot. Bonds4

About [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol

[1-(cyclohexylamino)-4-ethylcyclohexyl]methanol (PubChem CID 61046557) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol.

Molecular Properties

Compound Name[1-(cyclohexylamino)-4-ethylcyclohexyl]methanol
PubChem CID61046557
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name[1-(cyclohexylamino)-4-ethylcyclohexyl]methanol
SMILESCCC1CCC(CO)(NC2CCCCC2)CC1
InChIInChI=1S/C15H29NO/c1-2-13-8-10-15(12-17,11-9-13)16-14-6-4-3-5-7-14/h13-14,16-17H,2-12H2,1H3
InChIKeyWGPMGJPKFQTTJG-UHFFFAOYSA-N
XLogP3.24
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 ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol?
The IUPAC name of [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol (CID 61046557) is [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol.
What is the SMILES notation for [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol?
The canonical SMILES for [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol is CCC1CCC(CO)(NC2CCCCC2)CC1.
What is the InChIKey of [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol?
The InChIKey is WGPMGJPKFQTTJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-2-13-8-10-15(12-17,11-9-13)16-14-6-4-3-5-7-14/h13-14,16-17H,2-12H2,1H3.
What are the key properties of [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol?
[1-(cyclohexylamino)-4-ethylcyclohexyl]methanol has a molecular weight of 239.40 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclohexylamino)-4-ethylcyclohexyl]methanol is sourced from PubChem (CID 61046557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).