[3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine

C10H15N3O — CID 112709653

IUPAC[3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine
SMILESCc1cnc(N2CC3C(CN)C3C2)o1
InChIInChI=1S/C10H15N3O/c1-6-3-12-10(14-6)13-4-8-7(2-11)9(8)5-13/h3,7-9H,2,4-5,11H2,1H3
InChIKeyFDELDKYJUNNVDY-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.62
Rot. Bonds2

About [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine

[3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine (PubChem CID 112709653) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine.

Molecular Properties

Compound Name[3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine
PubChem CID112709653
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name[3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine
SMILESCc1cnc(N2CC3C(CN)C3C2)o1
InChIInChI=1S/C10H15N3O/c1-6-3-12-10(14-6)13-4-8-7(2-11)9(8)5-13/h3,7-9H,2,4-5,11H2,1H3
InChIKeyFDELDKYJUNNVDY-UHFFFAOYSA-N
XLogP0.62
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine?
The IUPAC name of [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine (CID 112709653) is [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine.
What is the SMILES notation for [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine?
The canonical SMILES for [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine is Cc1cnc(N2CC3C(CN)C3C2)o1.
What is the InChIKey of [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine?
The InChIKey is FDELDKYJUNNVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-6-3-12-10(14-6)13-4-8-7(2-11)9(8)5-13/h3,7-9H,2,4-5,11H2,1H3.
What are the key properties of [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine?
[3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine has a molecular weight of 193.25 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-methyl-1,3-oxazol-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanamine is sourced from PubChem (CID 112709653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).