1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol

C9H19NO2 — CID 106938597

IUPAC1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol
SMILESCNCC1CC(OCC(C)O)C1
InChIInChI=1S/C9H19NO2/c1-7(11)6-12-9-3-8(4-9)5-10-2/h7-11H,3-6H2,1-2H3
InChIKeyLQHZTXYDSSHBRE-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.38
Rot. Bonds5

About 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol

1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol (PubChem CID 106938597) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol.

Molecular Properties

Compound Name1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol
PubChem CID106938597
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol
SMILESCNCC1CC(OCC(C)O)C1
InChIInChI=1S/C9H19NO2/c1-7(11)6-12-9-3-8(4-9)5-10-2/h7-11H,3-6H2,1-2H3
InChIKeyLQHZTXYDSSHBRE-UHFFFAOYSA-N
XLogP0.38
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(2,2-dimethoxyethoxy)cyclobutyl]-N-methylmethanamine
CID 115486785
1-(2-methoxyethoxy)-3-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol
CID 106991250
1-cyclododecyloxypropan-2-ol
CID 54403914
methyl 3-[3-(methylaminomethyl)cyclobutyl]oxypropanoate
CID 106940433
N-methyl-1-[4-(2-methylpropyl)cyclohexyl]methanamine
CID 155019686
1-(3-hept-6-enoxycyclobutyl)-N-methylmethanamine
CID 107007732
1-(3-fluorocyclobutyl)-N-methylmethanamine
CID 105430010
2-methylpropyl 3-(methylaminomethyl)pyrrolidine-1-carboxylate
CID 63263913
1-[4-(4-methylcyclohexyl)cyclohexyl]oxypropan-2-ol;1-methyl-4-[4-(2-methylpropoxy)cyclohexyl]cyclohexane
CID 54211881
1-[3-[(2-chloro-4-methylphenyl)methoxy]cyclobutyl]-N-methylmethanamine
CID 106864784
1-[3-[(3-cyclopropylimidazol-4-yl)methoxy]cyclobutyl]-N-methylmethanamine
CID 106938573
1-(4-aminocyclohexyl)oxy-3-methylbutan-2-ol
CID 121379144

Frequently Asked Questions

What is the IUPAC name of 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol?
The IUPAC name of 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol (CID 106938597) is 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol.
What is the SMILES notation for 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol?
The canonical SMILES for 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol is CNCC1CC(OCC(C)O)C1.
What is the InChIKey of 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol?
The InChIKey is LQHZTXYDSSHBRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-7(11)6-12-9-3-8(4-9)5-10-2/h7-11H,3-6H2,1-2H3.
What are the key properties of 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol?
1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol has a molecular weight of 173.26 g/mol, XLogP of 0.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(methylaminomethyl)cyclobutyl]oxypropan-2-ol is sourced from PubChem (CID 106938597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).