[1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane

C10H21NO — CID 164878810

IUPAC[1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane
SMILESCC.OCC1(CN2CCC2)CC1
InChIInChI=1S/C8H15NO.C2H6/c10-7-8(2-3-8)6-9-4-1-5-9;1-2/h10H,1-7H2;1-2H3
InChIKeySSWIGMLTKIMUDH-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.49
Rot. Bonds3

About [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane

[1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane (PubChem CID 164878810) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane.

Molecular Properties

Compound Name[1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane
PubChem CID164878810
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name[1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane
SMILESCC.OCC1(CN2CCC2)CC1
InChIInChI=1S/C8H15NO.C2H6/c10-7-8(2-3-8)6-9-4-1-5-9;1-2/h10H,1-7H2;1-2H3
InChIKeySSWIGMLTKIMUDH-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane?
The IUPAC name of [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane (CID 164878810) is [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane.
What is the SMILES notation for [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane?
The canonical SMILES for [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane is CC.OCC1(CN2CCC2)CC1.
What is the InChIKey of [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane?
The InChIKey is SSWIGMLTKIMUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.C2H6/c10-7-8(2-3-8)6-9-4-1-5-9;1-2/h10H,1-7H2;1-2H3.
What are the key properties of [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane?
[1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane has a molecular weight of 171.28 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(azetidin-1-ylmethyl)cyclopropyl]methanol;ethane is sourced from PubChem (CID 164878810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).