[3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride

C7H16ClNO — CID 155895170

IUPAC[3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride
SMILESCNC1(CO)CC(C)C1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-6-3-7(4-6,5-9)8-2;/h6,8-9H,3-5H2,1-2H3;1H
InChIKeyIZESZUPKCJYUBW-UHFFFAOYSA-N
MW165.66 g/mol
LogP0.79
Rot. Bonds2

About [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride

[3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride (PubChem CID 155895170) has the molecular formula C7H16ClNO and a molecular weight of 165.66 g/mol. Its IUPAC name is [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride.

Molecular Properties

Compound Name[3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride
PubChem CID155895170
Molecular FormulaC7H16ClNO
Molecular Weight165.66 g/mol
Exact Mass165.09
IUPAC Name[3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride
SMILESCNC1(CO)CC(C)C1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-6-3-7(4-6,5-9)8-2;/h6,8-9H,3-5H2,1-2H3;1H
InChIKeyIZESZUPKCJYUBW-UHFFFAOYSA-N
XLogP0.79
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.66
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[3-fluoro-1-(methylamino)cyclobutyl]methanol
CID 91027570
[8-methyl-3-(methylamino)-8-azabicyclo[3.2.1]octan-3-yl]methanol
CID 61054110
[3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclopentyl]methanol
CID 79646760
[3-cyclopropyl-1-(methylamino)cyclohexyl]methanol
CID 64623011
[1-(methylamino)-3-(3-methylcyclohexyl)sulfanylcyclopentyl]methanol
CID 79645546
[1-(ethylamino)-3,3,5-trimethylcyclohexyl]methanol
CID 61050703
[1-(3-fluoro-5-methylanilino)-3-methylcyclobutyl]methanol
CID 103564816
[1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol
CID 79645826
[3-cyclopentylsulfanyl-1-(methylamino)cyclopentyl]methanol
CID 79646566
[1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol
CID 103564776
1-(aminomethyl)-N,3,3,5-tetramethylcyclohexan-1-amine
CID 62066180
[1-(cyclopentylamino)-3,3,5-trimethylcyclohexyl]methanol
CID 61055766

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride?
The IUPAC name of [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride (CID 155895170) is [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride.
What is the SMILES notation for [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride?
The canonical SMILES for [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride is CNC1(CO)CC(C)C1.Cl.
What is the InChIKey of [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride?
The InChIKey is IZESZUPKCJYUBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.ClH/c1-6-3-7(4-6,5-9)8-2;/h6,8-9H,3-5H2,1-2H3;1H.
What are the key properties of [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride?
[3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride has a molecular weight of 165.66 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(methylamino)cyclobutyl]methanol;hydrochloride is sourced from PubChem (CID 155895170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).