[3-(methylamino)cyclobutyl]methanol

C6H13NO — CID 53302281

IUPAC[3-(methylamino)cyclobutyl]methanol
SMILESCNC1CC(CO)C1
InChIInChI=1S/C6H13NO/c1-7-6-2-5(3-6)4-8/h5-8H,2-4H2,1H3
InChIKeyLXXIHOWGNXTMOG-UHFFFAOYSA-N
MW115.18 g/mol
LogP-0.02
Rot. Bonds2

About [3-(methylamino)cyclobutyl]methanol

[3-(methylamino)cyclobutyl]methanol (PubChem CID 53302281) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is [3-(methylamino)cyclobutyl]methanol.

Molecular Properties

Compound Name[3-(methylamino)cyclobutyl]methanol
PubChem CID53302281
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name[3-(methylamino)cyclobutyl]methanol
SMILESCNC1CC(CO)C1
InChIInChI=1S/C6H13NO/c1-7-6-2-5(3-6)4-8/h5-8H,2-4H2,1H3
InChIKeyLXXIHOWGNXTMOG-UHFFFAOYSA-N
XLogP-0.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(methylamino)cyclobutyl]methanol?
The IUPAC name of [3-(methylamino)cyclobutyl]methanol (CID 53302281) is [3-(methylamino)cyclobutyl]methanol.
What is the SMILES notation for [3-(methylamino)cyclobutyl]methanol?
The canonical SMILES for [3-(methylamino)cyclobutyl]methanol is CNC1CC(CO)C1.
What is the InChIKey of [3-(methylamino)cyclobutyl]methanol?
The InChIKey is LXXIHOWGNXTMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-7-6-2-5(3-6)4-8/h5-8H,2-4H2,1H3.
What are the key properties of [3-(methylamino)cyclobutyl]methanol?
[3-(methylamino)cyclobutyl]methanol has a molecular weight of 115.18 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methylamino)cyclobutyl]methanol is sourced from PubChem (CID 53302281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).