[1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride

C8H18ClNO — CID 155893479

IUPAC[1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride
SMILESCNC(C)C1(CO)CCC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-7(9-2)8(6-10)4-3-5-8;/h7,9-10H,3-6H2,1-2H3;1H
InChIKeyLYECAUMBGJYCLW-UHFFFAOYSA-N
MW179.69 g/mol
LogP1.18
Rot. Bonds3

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

[1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride (PubChem CID 155893479) has the molecular formula C8H18ClNO and a molecular weight of 179.69 g/mol. Its IUPAC name is [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride.

Molecular Properties

Compound Name[1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride
PubChem CID155893479
Molecular FormulaC8H18ClNO
Molecular Weight179.69 g/mol
Exact Mass179.11
IUPAC Name[1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride
SMILESCNC(C)C1(CO)CCC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-7(9-2)8(6-10)4-3-5-8;/h7,9-10H,3-6H2,1-2H3;1H
InChIKeyLYECAUMBGJYCLW-UHFFFAOYSA-N
XLogP1.18
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.69
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride?
The IUPAC name of [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride (CID 155893479) is [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride.
What is the SMILES notation for [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride?
The canonical SMILES for [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride is CNC(C)C1(CO)CCC1.Cl.
What is the InChIKey of [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride?
The InChIKey is LYECAUMBGJYCLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.ClH/c1-7(9-2)8(6-10)4-3-5-8;/h7,9-10H,3-6H2,1-2H3;1H.
What are the key properties of [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride?
[1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride has a molecular weight of 179.69 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-(methylamino)ethyl]cyclobutyl]methanol;hydrochloride is sourced from PubChem (CID 155893479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).