2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol

C16H31NO2 — CID 62707954

IUPAC2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol
SMILESCC1CN(CC2CC(C(C)C)CCC2O)C(C)CO1
InChIInChI=1S/C16H31NO2/c1-11(2)14-5-6-16(18)15(7-14)9-17-8-13(4)19-10-12(17)3/h11-16,18H,5-10H2,1-4H3
InChIKeyCSHIESOEPUIMBQ-UHFFFAOYSA-N
MW269.43 g/mol
LogP2.53
Rot. Bonds3

About 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol

2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol (PubChem CID 62707954) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol
PubChem CID62707954
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC Name2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol
SMILESCC1CN(CC2CC(C(C)C)CCC2O)C(C)CO1
InChIInChI=1S/C16H31NO2/c1-11(2)14-5-6-16(18)15(7-14)9-17-8-13(4)19-10-12(17)3/h11-16,18H,5-10H2,1-4H3
InChIKeyCSHIESOEPUIMBQ-UHFFFAOYSA-N
XLogP2.53
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-methylcyclohexan-1-ol
CID 62610594
2-[(3-methylpyrrolidin-1-yl)methyl]-4-propan-2-ylcyclohexan-1-ol
CID 62703990
2-[[3-(dimethylamino)-4-methylpyrrolidin-1-yl]methyl]-4-propan-2-ylcyclohexan-1-ol
CID 81468984
2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine
CID 62615947
2,5-dimethyl-4-[(4-methylpyrrolidin-3-yl)methyl]morpholine
CID 63713863
2-(4-methylpentyl)-4-propan-2-ylcyclohexan-1-ol
CID 83161089
2-ethyl-4-propan-2-ylcyclohexan-1-ol
CID 58534339
8-[(2-hydroxy-5-propan-2-ylcyclohexyl)methyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 63769113
4-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-amine
CID 66236109
2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-ethylcyclohexan-1-amine
CID 62615942
2-(2-hydroxypropyl)-4-propan-2-ylcyclohexan-1-ol
CID 79423024
2-(3,3-dimethylbutyl)-4-propan-2-ylcyclohexan-1-ol
CID 63459622

Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol (CID 62707954) is 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol is CC1CN(CC2CC(C(C)C)CCC2O)C(C)CO1.
What is the InChIKey of 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is CSHIESOEPUIMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2/c1-11(2)14-5-6-16(18)15(7-14)9-17-8-13(4)19-10-12(17)3/h11-16,18H,5-10H2,1-4H3.
What are the key properties of 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol?
2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 269.43 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dimethylmorpholin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 62707954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).