[1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol

C15H30N2O — CID 81418798

IUPAC[1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol
SMILESCCN1CCC(CNCC2(CO)CCCCC2)C1
InChIInChI=1S/C15H30N2O/c1-2-17-9-6-14(11-17)10-16-12-15(13-18)7-4-3-5-8-15/h14,16,18H,2-13H2,1H3
InChIKeyKKXHUVKVSNAGJX-UHFFFAOYSA-N
MW254.42 g/mol
LogP1.86
Rot. Bonds6

About [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol

[1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol (PubChem CID 81418798) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol
PubChem CID81418798
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name[1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol
SMILESCCN1CCC(CNCC2(CO)CCCCC2)C1
InChIInChI=1S/C15H30N2O/c1-2-17-9-6-14(11-17)10-16-12-15(13-18)7-4-3-5-8-15/h14,16,18H,2-13H2,1H3
InChIKeyKKXHUVKVSNAGJX-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol with MolForge

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Related Compounds

[1-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclopentyl]methanol
CID 113293535
[1-[[(1-ethylpyrrolidin-2-yl)methylamino]methyl]cyclohexyl]methanol
CID 81411194
[1-[[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methylamino]methyl]cyclohexyl]methanol
CID 81419716
N-[[1-[(3-ethylpyrrolidin-1-yl)methyl]cyclohexyl]methyl]ethanamine
CID 113418861
[1-[[(1-methylpiperidin-2-yl)methylamino]methyl]cyclohexyl]methanol
CID 81419235
[1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol
CID 81419179
2-[1-(aminomethyl)cyclobutyl]-N-[(1-ethylpyrrolidin-3-yl)methyl]acetamide
CID 81179908
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111537146
[1-[[1-(hydroxymethyl)cyclopentyl]methyl]pyrrolidin-3-yl]methanol
CID 112629225
[1-[[(1-propylpiperidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 81412863
(E)-N-[(1-ethylpyrrolidin-3-yl)methyl]-3-phenylprop-2-en-1-amine
CID 62339428
[1-[(2-cyclopropylethylamino)methyl]cyclohexyl]methanol
CID 81419373

Frequently Asked Questions

What is the IUPAC name of [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol (CID 81418798) is [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol is CCN1CCC(CNCC2(CO)CCCCC2)C1.
What is the InChIKey of [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol?
The InChIKey is KKXHUVKVSNAGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-17-9-6-14(11-17)10-16-12-15(13-18)7-4-3-5-8-15/h14,16,18H,2-13H2,1H3.
What are the key properties of [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol?
[1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol has a molecular weight of 254.42 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 81418798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).