[1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol

C14H30N2O2 — CID 114126917

IUPAC[1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol
SMILESCN(C)CCOCCNCC1(CO)CCCCC1
InChIInChI=1S/C14H30N2O2/c1-16(2)9-11-18-10-8-15-12-14(13-17)6-4-3-5-7-14/h15,17H,3-13H2,1-2H3
InChIKeyNOUOWWBZSXXZJN-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.10
Rot. Bonds9

About [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol

[1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol (PubChem CID 114126917) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol
PubChem CID114126917
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name[1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol
SMILESCN(C)CCOCCNCC1(CO)CCCCC1
InChIInChI=1S/C14H30N2O2/c1-16(2)9-11-18-10-8-15-12-14(13-17)6-4-3-5-7-14/h15,17H,3-13H2,1-2H3
InChIKeyNOUOWWBZSXXZJN-UHFFFAOYSA-N
XLogP1.10
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[1-[[2-(2,2,2-Trifluoroethoxy)ethylamino]methyl]cyclohexyl]methanol
CID 81419255
[1-[[2-(Trifluoromethoxy)ethylamino]methyl]cyclohexyl]methanol
CID 103966514
[1-[[2-(2,2-Difluoroethoxy)ethylamino]methyl]cyclohexyl]methanol
CID 105905440
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)decan-1-ol
CID 122416746
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)dodecan-1-ol
CID 122416747
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)undecan-1-ol
CID 122416748
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)octadecan-1-ol
CID 122416753
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)tridecan-1-ol
CID 122416754
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)heptadecan-1-ol
CID 122416755
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)tetradecan-1-ol
CID 122416758
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)pentadecan-1-ol
CID 122416760
2-Methyl-2-(1,4,10-trioxa-7,13-diazacyclopentadec-7-ylmethyl)hexadecan-1-ol
CID 122416768

Frequently Asked Questions

What is the IUPAC name of [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol (CID 114126917) is [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol is CN(C)CCOCCNCC1(CO)CCCCC1.
What is the InChIKey of [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol?
The InChIKey is NOUOWWBZSXXZJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-16(2)9-11-18-10-8-15-12-14(13-17)6-4-3-5-7-14/h15,17H,3-13H2,1-2H3.
What are the key properties of [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol?
[1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol has a molecular weight of 258.41 g/mol, XLogP of 1.10, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[2-[2-(dimethylamino)ethoxy]ethylamino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 114126917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).