2-[(3,5-dimethylcyclohexyl)amino]ethanol

C10H21NO — CID 64723200

IUPAC2-[(3,5-dimethylcyclohexyl)amino]ethanol
SMILESCC1CC(C)CC(NCCO)C1
InChIInChI=1S/C10H21NO/c1-8-5-9(2)7-10(6-8)11-3-4-12/h8-12H,3-7H2,1-2H3
InChIKeyNFXSSVNTGXJROS-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.39
Rot. Bonds3

About 2-[(3,5-dimethylcyclohexyl)amino]ethanol

2-[(3,5-dimethylcyclohexyl)amino]ethanol (PubChem CID 64723200) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-[(3,5-dimethylcyclohexyl)amino]ethanol.

Molecular Properties

Compound Name2-[(3,5-dimethylcyclohexyl)amino]ethanol
PubChem CID64723200
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-[(3,5-dimethylcyclohexyl)amino]ethanol
SMILESCC1CC(C)CC(NCCO)C1
InChIInChI=1S/C10H21NO/c1-8-5-9(2)7-10(6-8)11-3-4-12/h8-12H,3-7H2,1-2H3
InChIKeyNFXSSVNTGXJROS-UHFFFAOYSA-N
XLogP1.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[(3R,5S)-3,5-dimethylcyclohexyl]amino]propan-1-ol
CID 96732218
4-[(3,5-dimethylcyclohexyl)amino]butan-1-ol
CID 64731694
(2R)-4-[[(3S,5S)-3,5-dimethylcyclohexyl]amino]butan-2-ol
CID 96784232
N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64722982
5-[(3,5-dimethylcyclohexyl)amino]pentanoic acid
CID 103254539
N-heptyl-3,5-dimethylcyclohexan-1-amine
CID 64731854
2-[(2-methylpiperidin-4-yl)amino]ethanol
CID 164646040
N-dodecyl-3-methylcyclobutan-1-amine
CID 113467183
N-(3-ethylsulfonylpropyl)-3,5-dimethylcyclohexan-1-amine
CID 65093543
5-[(3,5-dimethylcyclohexyl)amino]pentanenitrile
CID 64734426
3-methyl-N-(2-methylsulfinylethyl)cyclobutan-1-amine
CID 104859809
6-[(3,5-dimethylcyclohexyl)amino]-4-methylhexanoic acid
CID 65289656

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethylcyclohexyl)amino]ethanol?
The IUPAC name of 2-[(3,5-dimethylcyclohexyl)amino]ethanol (CID 64723200) is 2-[(3,5-dimethylcyclohexyl)amino]ethanol.
What is the SMILES notation for 2-[(3,5-dimethylcyclohexyl)amino]ethanol?
The canonical SMILES for 2-[(3,5-dimethylcyclohexyl)amino]ethanol is CC1CC(C)CC(NCCO)C1.
What is the InChIKey of 2-[(3,5-dimethylcyclohexyl)amino]ethanol?
The InChIKey is NFXSSVNTGXJROS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-8-5-9(2)7-10(6-8)11-3-4-12/h8-12H,3-7H2,1-2H3.
What are the key properties of 2-[(3,5-dimethylcyclohexyl)amino]ethanol?
2-[(3,5-dimethylcyclohexyl)amino]ethanol has a molecular weight of 171.28 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethylcyclohexyl)amino]ethanol is sourced from PubChem (CID 64723200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).