[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol

C15H30N2O — CID 79633807

IUPAC[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol
SMILESCCNC1(CO)CCCC(N2CCCC2CC)C1
InChIInChI=1S/C15H30N2O/c1-3-13-8-6-10-17(13)14-7-5-9-15(11-14,12-18)16-4-2/h13-14,16,18H,3-12H2,1-2H3
InChIKeySTGOXVSHMLVYFY-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.14
Rot. Bonds5

About [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol

[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol (PubChem CID 79633807) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol
PubChem CID79633807
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol
SMILESCCNC1(CO)CCCC(N2CCCC2CC)C1
InChIInChI=1S/C15H30N2O/c1-3-13-8-6-10-17(13)14-7-5-9-15(11-14,12-18)16-4-2/h13-14,16,18H,3-12H2,1-2H3
InChIKeySTGOXVSHMLVYFY-UHFFFAOYSA-N
XLogP2.14
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclopentyl]methanol
CID 79656929
[3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol
CID 79640098
[1-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)cyclopentyl]methanol
CID 79657108
[1-(ethylamino)-3-(2-methylpiperidin-1-yl)cyclopentyl]methanol
CID 79656519
[1-(ethylamino)-3-(4-methoxypiperidin-1-yl)cyclohexyl]methanol
CID 79640451
[3-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-1-(ethylamino)cyclohexyl]methanol
CID 79640787
[1-(propan-2-ylamino)-3-(2-propylpiperidin-1-yl)cyclohexyl]methanol
CID 83046688
[1-(ethylamino)-3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]cyclohexyl]methanol
CID 79640639
methyl 1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclopentane-1-carboxylate
CID 79649918
[1-(ethylamino)-3-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexyl]methanol
CID 79640319
[1-(propylamino)-3-pyrrolidin-1-ylcyclohexyl]methanol
CID 79634717
3-(2-ethylpyrrolidin-1-yl)-1-(propylamino)cyclohexane-1-carboxamide
CID 79636030

Frequently Asked Questions

What is the IUPAC name of [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol?
The IUPAC name of [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol (CID 79633807) is [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol.
What is the SMILES notation for [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol?
The canonical SMILES for [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol is CCNC1(CO)CCCC(N2CCCC2CC)C1.
What is the InChIKey of [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol?
The InChIKey is STGOXVSHMLVYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-13-8-6-10-17(13)14-7-5-9-15(11-14,12-18)16-4-2/h13-14,16,18H,3-12H2,1-2H3.
What are the key properties of [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol?
[1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol has a molecular weight of 254.42 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylamino)-3-(2-ethylpyrrolidin-1-yl)cyclohexyl]methanol is sourced from PubChem (CID 79633807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).