2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine

C15H30N2O — CID 104958321

IUPAC2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine
SMILESCCC1CCC(NC)C(N2C[C@@H](C)O[C@@H](C)C2)C1
InChIInChI=1S/C15H30N2O/c1-5-13-6-7-14(16-4)15(8-13)17-9-11(2)18-12(3)10-17/h11-16H,5-10H2,1-4H3/t11-,12+,13?,14?,15?
InChIKeyDQJLDFVESHTIGH-HONBEQNRSA-N
MW254.42 g/mol
LogP2.26
Rot. Bonds3

About 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine

2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine (PubChem CID 104958321) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine
PubChem CID104958321
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine
SMILESCCC1CCC(NC)C(N2C[C@@H](C)O[C@@H](C)C2)C1
InChIInChI=1S/C15H30N2O/c1-5-13-6-7-14(16-4)15(8-13)17-9-11(2)18-12(3)10-17/h11-16H,5-10H2,1-4H3/t11-,12+,13?,14?,15?
InChIKeyDQJLDFVESHTIGH-HONBEQNRSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-4-ethyl-N-methylcyclohexan-1-amine
CID 113335646
2-(2,6-dimethylmorpholin-4-yl)-4-ethylcyclohexan-1-amine
CID 16794711
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-methylcyclopentan-1-amine
CID 104958406
4-ethyl-N-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclohexan-1-amine
CID 63169906
4-ethyl-N-methyl-2-(1,4-oxazepan-4-yl)cyclohexan-1-amine
CID 62986422
4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine
CID 66393072
4-ethyl-N-methyl-2-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)cyclohexan-1-amine
CID 79920835
2-(3,4-dimethoxypyrrolidin-1-yl)-N-methyl-4-propylcyclohexan-1-amine
CID 103532456
2-(2,6-dimethylmorpholin-4-yl)-4-propylcyclohexane-1-carboxylic acid
CID 63068743
2-(3,4-dimethoxypyrrolidin-1-yl)-4-ethyl-N-propylcyclohexan-1-amine
CID 103532460
4-ethyl-2-(4-methylpiperidin-1-yl)-N-propylcyclohexan-1-amine
CID 55192276
4-tert-butyl-2-(4-ethylpiperidin-1-yl)-N-methylcyclohexan-1-amine
CID 63468858

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine?
The IUPAC name of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine (CID 104958321) is 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine.
What is the SMILES notation for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine?
The canonical SMILES for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine is CCC1CCC(NC)C(N2C[C@@H](C)O[C@@H](C)C2)C1.
What is the InChIKey of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine?
The InChIKey is DQJLDFVESHTIGH-HONBEQNRSA-N. The full InChI is InChI=1S/C15H30N2O/c1-5-13-6-7-14(16-4)15(8-13)17-9-11(2)18-12(3)10-17/h11-16H,5-10H2,1-4H3/t11-,12+,13?,14?,15?.
What are the key properties of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine?
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine has a molecular weight of 254.42 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine is sourced from PubChem (CID 104958321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).