[3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol

C15H32N2O2 — CID 79640869

IUPAC[3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
SMILESCCN(CCOC)C1CCCC(CO)(NC(C)C)C1
InChIInChI=1S/C15H32N2O2/c1-5-17(9-10-19-4)14-7-6-8-15(11-14,12-18)16-13(2)3/h13-14,16,18H,5-12H2,1-4H3
InChIKeyHULZOXMEJHTCPC-UHFFFAOYSA-N
MW272.43 g/mol
LogP1.63
Rot. Bonds8

About [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol

[3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol (PubChem CID 79640869) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
PubChem CID79640869
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name[3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
SMILESCCN(CCOC)C1CCCC(CO)(NC(C)C)C1
InChIInChI=1S/C15H32N2O2/c1-5-17(9-10-19-4)14-7-6-8-15(11-14,12-18)16-13(2)3/h13-14,16,18H,5-12H2,1-4H3
InChIKeyHULZOXMEJHTCPC-UHFFFAOYSA-N
XLogP1.63
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[3-[ethyl(methyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79635385
1-amino-3-[ethyl(2-methoxyethyl)amino]cyclohexane-1-carboxylic acid
CID 79641683
[3-[2-(dimethylamino)ethyl-methylamino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79635513
[3-[2-methoxyethyl(2-methylpropyl)amino]-1-(methylamino)cyclopentyl]methanol
CID 79655970
[3-[methyl(3-methylbutyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79640094
[3-methoxy-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79640901
[3-[butyl(ethyl)amino]-1-(ethylamino)cyclohexyl]methanol
CID 79633810
[3-[cyclopropylmethyl(propyl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656704
3-[2-ethoxyethyl(ethyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxylic acid
CID 79650786
[3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656766
[3-[methyl-(2-methylcyclohexyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79634733
methyl 3-[butyl(ethyl)amino]-1-(propan-2-ylamino)cyclohexane-1-carboxylate
CID 79627274

Frequently Asked Questions

What is the IUPAC name of [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol?
The IUPAC name of [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol (CID 79640869) is [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol.
What is the SMILES notation for [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol?
The canonical SMILES for [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol is CCN(CCOC)C1CCCC(CO)(NC(C)C)C1.
What is the InChIKey of [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol?
The InChIKey is HULZOXMEJHTCPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2/c1-5-17(9-10-19-4)14-7-6-8-15(11-14,12-18)16-13(2)3/h13-14,16,18H,5-12H2,1-4H3.
What are the key properties of [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol?
[3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol has a molecular weight of 272.43 g/mol, XLogP of 1.63, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[ethyl(2-methoxyethyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol is sourced from PubChem (CID 79640869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).