2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol

C15H30N2O — CID 106606785

IUPAC2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESCC1CCCC(C)C1N(CCO)CC1CCCN1
InChIInChI=1S/C15H30N2O/c1-12-5-3-6-13(2)15(12)17(9-10-18)11-14-7-4-8-16-14/h12-16,18H,3-11H2,1-2H3
InChIKeyYBRXQFLHJFWIDB-UHFFFAOYSA-N
MW254.42 g/mol
LogP1.86
Rot. Bonds5

About 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol

2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol (PubChem CID 106606785) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol
PubChem CID106606785
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESCC1CCCC(C)C1N(CCO)CC1CCCN1
InChIInChI=1S/C15H30N2O/c1-12-5-3-6-13(2)15(12)17(9-10-18)11-14-7-4-8-16-14/h12-16,18H,3-11H2,1-2H3
InChIKeyYBRXQFLHJFWIDB-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)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-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)cyclopentan-1-amine
CID 106604021
2-[(1-methylpyrrolidin-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106606838
3-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-1-methylpyrrolidin-2-one
CID 106617859
2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106606511
2-[(1-propylpiperidin-4-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106607106
2-[2-(dimethylamino)ethyl-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106618094
2-[1-cyclopropylethyl(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106606811
N-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexanamine
CID 106603994
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106617908
2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106621336
N-(2-hydroxyethyl)-4-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexane-1-carboxamide
CID 106612534
3-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-2-methylpropanenitrile
CID 106617970

Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The IUPAC name of 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol (CID 106606785) is 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol is CC1CCCC(C)C1N(CCO)CC1CCCN1.
What is the InChIKey of 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The InChIKey is YBRXQFLHJFWIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12-5-3-6-13(2)15(12)17(9-10-18)11-14-7-4-8-16-14/h12-16,18H,3-11H2,1-2H3.
What are the key properties of 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol has a molecular weight of 254.42 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dimethylcyclohexyl)-(pyrrolidin-2-ylmethyl)amino]ethanol is sourced from PubChem (CID 106606785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).