(6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol

C7H13NO — CID 84647976

IUPAC(6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol
SMILESCC1(CO)C2CNCC21
InChIInChI=1S/C7H13NO/c1-7(4-9)5-2-8-3-6(5)7/h5-6,8-9H,2-4H2,1H3
InChIKeyQEXKMWIAKHPUJV-UHFFFAOYSA-N
MW127.19 g/mol
LogP-0.17
Rot. Bonds1

About (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol

(6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol (PubChem CID 84647976) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol.

Molecular Properties

Compound Name(6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol
PubChem CID84647976
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name(6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol
SMILESCC1(CO)C2CNCC21
InChIInChI=1S/C7H13NO/c1-7(4-9)5-2-8-3-6(5)7/h5-6,8-9H,2-4H2,1H3
InChIKeyQEXKMWIAKHPUJV-UHFFFAOYSA-N
XLogP-0.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol?
The IUPAC name of (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol (CID 84647976) is (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol.
What is the SMILES notation for (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol?
The canonical SMILES for (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol is CC1(CO)C2CNCC21.
What is the InChIKey of (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol?
The InChIKey is QEXKMWIAKHPUJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-7(4-9)5-2-8-3-6(5)7/h5-6,8-9H,2-4H2,1H3.
What are the key properties of (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol?
(6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol has a molecular weight of 127.19 g/mol, XLogP of -0.17, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol is sourced from PubChem (CID 84647976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).