N-(1,2-oxazol-5-ylmethyl)cyclopropanamine

C7H10N2O — CID 60687419

IUPACN-(1,2-oxazol-5-ylmethyl)cyclopropanamine
SMILESc1cc(CNC2CC2)on1
InChIInChI=1S/C7H10N2O/c1-2-6(1)8-5-7-3-4-9-10-7/h3-4,6,8H,1-2,5H2
InChIKeyNXMZYTXLGOTCMP-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.93
Rot. Bonds3

About N-(1,2-oxazol-5-ylmethyl)cyclopropanamine

N-(1,2-oxazol-5-ylmethyl)cyclopropanamine (PubChem CID 60687419) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is N-(1,2-oxazol-5-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(1,2-oxazol-5-ylmethyl)cyclopropanamine
PubChem CID60687419
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC NameN-(1,2-oxazol-5-ylmethyl)cyclopropanamine
SMILESc1cc(CNC2CC2)on1
InChIInChI=1S/C7H10N2O/c1-2-6(1)8-5-7-3-4-9-10-7/h3-4,6,8H,1-2,5H2
InChIKeyNXMZYTXLGOTCMP-UHFFFAOYSA-N
XLogP0.93
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-5-ylmethyl)cyclopropanamine?
The IUPAC name of N-(1,2-oxazol-5-ylmethyl)cyclopropanamine (CID 60687419) is N-(1,2-oxazol-5-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-(1,2-oxazol-5-ylmethyl)cyclopropanamine?
The canonical SMILES for N-(1,2-oxazol-5-ylmethyl)cyclopropanamine is c1cc(CNC2CC2)on1.
What is the InChIKey of N-(1,2-oxazol-5-ylmethyl)cyclopropanamine?
The InChIKey is NXMZYTXLGOTCMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-2-6(1)8-5-7-3-4-9-10-7/h3-4,6,8H,1-2,5H2.
What are the key properties of N-(1,2-oxazol-5-ylmethyl)cyclopropanamine?
N-(1,2-oxazol-5-ylmethyl)cyclopropanamine has a molecular weight of 138.17 g/mol, XLogP of 0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-5-ylmethyl)cyclopropanamine is sourced from PubChem (CID 60687419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).