[1-(ethylamino)-4-propylcyclohexyl]methanol

C12H25NO — CID 61048928

IUPAC[1-(ethylamino)-4-propylcyclohexyl]methanol
SMILESCCCC1CCC(CO)(NCC)CC1
InChIInChI=1S/C12H25NO/c1-3-5-11-6-8-12(10-14,9-7-11)13-4-2/h11,13-14H,3-10H2,1-2H3
InChIKeyAKEBRHXSPAWAMU-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.32
Rot. Bonds5

About [1-(ethylamino)-4-propylcyclohexyl]methanol

[1-(ethylamino)-4-propylcyclohexyl]methanol (PubChem CID 61048928) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is [1-(ethylamino)-4-propylcyclohexyl]methanol.

Molecular Properties

Compound Name[1-(ethylamino)-4-propylcyclohexyl]methanol
PubChem CID61048928
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name[1-(ethylamino)-4-propylcyclohexyl]methanol
SMILESCCCC1CCC(CO)(NCC)CC1
InChIInChI=1S/C12H25NO/c1-3-5-11-6-8-12(10-14,9-7-11)13-4-2/h11,13-14H,3-10H2,1-2H3
InChIKeyAKEBRHXSPAWAMU-UHFFFAOYSA-N
XLogP2.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-Cyclohexyl-2-(methylamino)ethan-1-ol
CID 89518
trans-(4-Methylaminomethyl-cyclohexyl)-methanol
CID 22236270
1-Azaspiro[3.5]nonan-7-ylmethanol
CID 71758176
2-Cyclohexyl-2-(2-methoxyethylamino)propan-1-ol
CID 64759521
2-Cyclohexyl-2-(methylamino)ethanol
CID 278542
2-(Tert-butylamino)-1-cyclohexylethanol
CID 62772381
(1R,2S,5R)-5-methyl-2-[2-(2-methylpropylamino)propan-2-yl]cyclohexan-1-ol
CID 134897432
2-Cyclohexyl-2-((2,2,2-trifluoroethyl)amino)propan-1-ol
CID 56794360
[4-Propyl-1-(2,2,2-trifluoroethylamino)cyclohexyl]methanol
CID 61045105
[4-Methyl-1-(2,2,2-trifluoroethylamino)cyclohexyl]methanol
CID 61045108
[4-Tert-butyl-1-(2,2,2-trifluoroethylamino)cyclohexyl]methanol
CID 61045651
[4-(2-Methylbutan-2-yl)-1-(2,2,2-trifluoroethylamino)cyclohexyl]methanol
CID 61046754

Frequently Asked Questions

What is the IUPAC name of [1-(ethylamino)-4-propylcyclohexyl]methanol?
The IUPAC name of [1-(ethylamino)-4-propylcyclohexyl]methanol (CID 61048928) is [1-(ethylamino)-4-propylcyclohexyl]methanol.
What is the SMILES notation for [1-(ethylamino)-4-propylcyclohexyl]methanol?
The canonical SMILES for [1-(ethylamino)-4-propylcyclohexyl]methanol is CCCC1CCC(CO)(NCC)CC1.
What is the InChIKey of [1-(ethylamino)-4-propylcyclohexyl]methanol?
The InChIKey is AKEBRHXSPAWAMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-3-5-11-6-8-12(10-14,9-7-11)13-4-2/h11,13-14H,3-10H2,1-2H3.
What are the key properties of [1-(ethylamino)-4-propylcyclohexyl]methanol?
[1-(ethylamino)-4-propylcyclohexyl]methanol has a molecular weight of 199.34 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylamino)-4-propylcyclohexyl]methanol is sourced from PubChem (CID 61048928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).