[3-(aminomethyl)cyclobutyl]methanol;hydrochloride

C6H14ClNO — CID 112756814

IUPAC[3-(aminomethyl)cyclobutyl]methanol;hydrochloride
SMILESCl.NCC1CC(CO)C1
InChIInChI=1S/C6H13NO.ClH/c7-3-5-1-6(2-5)4-8;/h5-6,8H,1-4,7H2;1H
InChIKeyKAFPROAYXUBOEX-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.39
Rot. Bonds2

About [3-(aminomethyl)cyclobutyl]methanol;hydrochloride

[3-(aminomethyl)cyclobutyl]methanol;hydrochloride (PubChem CID 112756814) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is [3-(aminomethyl)cyclobutyl]methanol;hydrochloride.

Molecular Properties

Compound Name[3-(aminomethyl)cyclobutyl]methanol;hydrochloride
PubChem CID112756814
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name[3-(aminomethyl)cyclobutyl]methanol;hydrochloride
SMILESCl.NCC1CC(CO)C1
InChIInChI=1S/C6H13NO.ClH/c7-3-5-1-6(2-5)4-8;/h5-6,8H,1-4,7H2;1H
InChIKeyKAFPROAYXUBOEX-UHFFFAOYSA-N
XLogP0.39
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(aminomethyl)cyclobutyl]methanol;hydrochloride?
The IUPAC name of [3-(aminomethyl)cyclobutyl]methanol;hydrochloride (CID 112756814) is [3-(aminomethyl)cyclobutyl]methanol;hydrochloride.
What is the SMILES notation for [3-(aminomethyl)cyclobutyl]methanol;hydrochloride?
The canonical SMILES for [3-(aminomethyl)cyclobutyl]methanol;hydrochloride is Cl.NCC1CC(CO)C1.
What is the InChIKey of [3-(aminomethyl)cyclobutyl]methanol;hydrochloride?
The InChIKey is KAFPROAYXUBOEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c7-3-5-1-6(2-5)4-8;/h5-6,8H,1-4,7H2;1H.
What are the key properties of [3-(aminomethyl)cyclobutyl]methanol;hydrochloride?
[3-(aminomethyl)cyclobutyl]methanol;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(aminomethyl)cyclobutyl]methanol;hydrochloride is sourced from PubChem (CID 112756814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).