2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol

C17H36N2O — CID 62610130

IUPAC2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol
SMILESCCCNC1CCC(CCC)CC1CN(CC)CCO
InChIInChI=1S/C17H36N2O/c1-4-7-15-8-9-17(18-10-5-2)16(13-15)14-19(6-3)11-12-20/h15-18,20H,4-14H2,1-3H3
InChIKeyNGBDMNHBURRGGK-UHFFFAOYSA-N
MW284.49 g/mol
LogP2.89
Rot. Bonds10

About 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol

2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol (PubChem CID 62610130) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol
PubChem CID62610130
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC Name2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol
SMILESCCCNC1CCC(CCC)CC1CN(CC)CCO
InChIInChI=1S/C17H36N2O/c1-4-7-15-8-9-17(18-10-5-2)16(13-15)14-19(6-3)11-12-20/h15-18,20H,4-14H2,1-3H3
InChIKeyNGBDMNHBURRGGK-UHFFFAOYSA-N
XLogP2.89
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol 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

2-[2-hydroxyethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol
CID 62610825
2-[[2-(ethylamino)-5-propylcyclohexyl]methyl-(2-hydroxyethyl)amino]ethanol
CID 62610658
2-[[ethyl(2-methoxyethyl)amino]methyl]-N,4-dipropylcyclohexan-1-amine
CID 63495212
2-[[2-(ethylamino)-5-propylcyclohexyl]methyl-propylamino]ethanol
CID 62610162
4-ethyl-2-[[ethyl(propyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 63483081
2-[butyl-[[2-(ethylamino)-5-propylcyclohexyl]methyl]amino]ethanol
CID 63493495
2-[[butan-2-yl(ethyl)amino]methyl]-N,4-dipropylcyclohexan-1-amine
CID 63483809
2-[2,2-difluoroethyl-[[2-(methylamino)-5-propylcyclohexyl]methyl]amino]ethanol
CID 107486531
2-[ethyl-[(4-propylcyclohexyl)methyl]amino]ethanol
CID 90928532
2-[(2-amino-5-propylcyclohexyl)methyl-propylamino]ethanol
CID 62610160
4-tert-butyl-2-[[ethyl(propyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 63483435
2-[cyclopropyl-[[2-(methylamino)-5-propylcyclohexyl]methyl]amino]ethanol
CID 55094432

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol?
The IUPAC name of 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol (CID 62610130) is 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol.
What is the SMILES notation for 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol?
The canonical SMILES for 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol is CCCNC1CCC(CCC)CC1CN(CC)CCO.
What is the InChIKey of 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol?
The InChIKey is NGBDMNHBURRGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-4-7-15-8-9-17(18-10-5-2)16(13-15)14-19(6-3)11-12-20/h15-18,20H,4-14H2,1-3H3.
What are the key properties of 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol?
2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol has a molecular weight of 284.49 g/mol, XLogP of 2.89, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[[5-propyl-2-(propylamino)cyclohexyl]methyl]amino]ethanol is sourced from PubChem (CID 62610130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).