2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine

C12H26N2O — CID 62610890

IUPAC2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine
SMILESCOCCN(C)CC1CC(C)CCC1N
InChIInChI=1S/C12H26N2O/c1-10-4-5-12(13)11(8-10)9-14(2)6-7-15-3/h10-12H,4-9,13H2,1-3H3
InChIKeyTVWSATWLTMVGNP-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.33
Rot. Bonds5

About 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine

2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine (PubChem CID 62610890) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine
PubChem CID62610890
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine
SMILESCOCCN(C)CC1CC(C)CCC1N
InChIInChI=1S/C12H26N2O/c1-10-4-5-12(13)11(8-10)9-14(2)6-7-15-3/h10-12H,4-9,13H2,1-3H3
InChIKeyTVWSATWLTMVGNP-UHFFFAOYSA-N
XLogP1.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine?
The IUPAC name of 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine (CID 62610890) is 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine.
What is the SMILES notation for 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine?
The canonical SMILES for 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine is COCCN(C)CC1CC(C)CCC1N.
What is the InChIKey of 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine?
The InChIKey is TVWSATWLTMVGNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10-4-5-12(13)11(8-10)9-14(2)6-7-15-3/h10-12H,4-9,13H2,1-3H3.
What are the key properties of 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine?
2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-methoxyethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine is sourced from PubChem (CID 62610890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).