2-[(1-methylcyclohexyl)methylamino]ethanol

C10H21NO — CID 106827219

IUPAC2-[(1-methylcyclohexyl)methylamino]ethanol
SMILESCC1(CNCCO)CCCCC1
InChIInChI=1S/C10H21NO/c1-10(9-11-7-8-12)5-3-2-4-6-10/h11-12H,2-9H2,1H3
InChIKeyXGGHBCXKEHVPQT-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.54
Rot. Bonds4

About 2-[(1-methylcyclohexyl)methylamino]ethanol

2-[(1-methylcyclohexyl)methylamino]ethanol (PubChem CID 106827219) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-[(1-methylcyclohexyl)methylamino]ethanol.

Molecular Properties

Compound Name2-[(1-methylcyclohexyl)methylamino]ethanol
PubChem CID106827219
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-[(1-methylcyclohexyl)methylamino]ethanol
SMILESCC1(CNCCO)CCCCC1
InChIInChI=1S/C10H21NO/c1-10(9-11-7-8-12)5-3-2-4-6-10/h11-12H,2-9H2,1H3
InChIKeyXGGHBCXKEHVPQT-UHFFFAOYSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-[(1-methylcyclohexyl)methyl]-N-(2-methylpropyl)ethane-1,2-diamine
CID 106827227
2-chloro-N-[(1-methylcyclobutyl)methyl]ethanamine
CID 130601571
3,3-dimethyl-N-[(1-methylcyclopentyl)methyl]butan-1-amine
CID 63821289
1-[[(1-methylcyclopentyl)methylamino]methyl]cyclopentan-1-ol
CID 65211055
1-cyclopentyl-N-[(1-methylcyclopentyl)methyl]methanamine
CID 63822365
(1-methylcyclododecyl)methanol
CID 70130772
N-[(1-methylcyclopentyl)methyl]-3-methylsulfonylpropan-1-amine
CID 63820774
2-methyl-2-[[(1-methylcyclopentyl)methylamino]methyl]butan-1-ol
CID 81418444
N-[(1-methylcyclopropyl)methyl]propan-1-amine
CID 66025109
(1-methylcyclotridecyl)methylhydrazine
CID 154988457
N-[(1-methylcycloheptyl)methyl]acetamide
CID 127751208
2-cyclohexyl-N-[(1-methylcyclopropyl)methyl]ethanamine
CID 103529144

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylcyclohexyl)methylamino]ethanol?
The IUPAC name of 2-[(1-methylcyclohexyl)methylamino]ethanol (CID 106827219) is 2-[(1-methylcyclohexyl)methylamino]ethanol.
What is the SMILES notation for 2-[(1-methylcyclohexyl)methylamino]ethanol?
The canonical SMILES for 2-[(1-methylcyclohexyl)methylamino]ethanol is CC1(CNCCO)CCCCC1.
What is the InChIKey of 2-[(1-methylcyclohexyl)methylamino]ethanol?
The InChIKey is XGGHBCXKEHVPQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-10(9-11-7-8-12)5-3-2-4-6-10/h11-12H,2-9H2,1H3.
What are the key properties of 2-[(1-methylcyclohexyl)methylamino]ethanol?
2-[(1-methylcyclohexyl)methylamino]ethanol has a molecular weight of 171.28 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylcyclohexyl)methylamino]ethanol is sourced from PubChem (CID 106827219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).