[1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol

C14H28N2O — CID 115247057

IUPAC[1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol
SMILESCN1CCCC(CN(C)CC2(CO)CCC2)C1
InChIInChI=1S/C14H28N2O/c1-15-8-3-5-13(9-15)10-16(2)11-14(12-17)6-4-7-14/h13,17H,3-12H2,1-2H3
InChIKeyRPNPZRVGSXJLGV-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.42
Rot. Bonds5

About [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol

[1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol (PubChem CID 115247057) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol.

Molecular Properties

Compound Name[1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol
PubChem CID115247057
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol
SMILESCN1CCCC(CN(C)CC2(CO)CCC2)C1
InChIInChI=1S/C14H28N2O/c1-15-8-3-5-13(9-15)10-16(2)11-14(12-17)6-4-7-14/h13,17H,3-12H2,1-2H3
InChIKeyRPNPZRVGSXJLGV-UHFFFAOYSA-N
XLogP1.42
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[[cyclohexylmethyl(methyl)amino]methyl]cyclobutyl]methanol
CID 115247051
[1-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclopropyl]methanol
CID 115243609
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methyl-1-(1-methylpiperidin-3-yl)methanamine
CID 115244261
[3-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]oxan-3-yl]methanol
CID 63745746
[1-[[cyclopropylmethyl(methyl)amino]methyl]cyclohexyl]methanol
CID 62272579
[1-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]cyclohexyl]methanol
CID 79312845
[1-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]cycloheptyl]methanol
CID 79312693
[1-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclopentyl]methanol
CID 113293535
[1-[(1-methylpiperidin-3-yl)methyl]cyclopropyl]methanol
CID 116928942
[1-[[(4-aminocyclohexyl)methyl-methylamino]methyl]cyclopentyl]methanol
CID 56741237
N-[(3-ethylpiperidin-3-yl)methyl]-N-methyl-1-(1-methylpyrrolidin-3-yl)methanamine
CID 63274170
N-methyl-1-(1-methylpiperidin-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride
CID 120898710

Frequently Asked Questions

What is the IUPAC name of [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol?
The IUPAC name of [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol (CID 115247057) is [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol.
What is the SMILES notation for [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol?
The canonical SMILES for [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol is CN1CCCC(CN(C)CC2(CO)CCC2)C1.
What is the InChIKey of [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol?
The InChIKey is RPNPZRVGSXJLGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-15-8-3-5-13(9-15)10-16(2)11-14(12-17)6-4-7-14/h13,17H,3-12H2,1-2H3.
What are the key properties of [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol?
[1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol has a molecular weight of 240.39 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol is sourced from PubChem (CID 115247057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).