3-(cyclopropylmethyl)-1,2-oxazol-5-amine

C7H10N2O — CID 54776320

IUPAC3-(cyclopropylmethyl)-1,2-oxazol-5-amine
SMILESNc1cc(CC2CC2)no1
InChIInChI=1S/C7H10N2O/c8-7-4-6(9-10-7)3-5-1-2-5/h4-5H,1-3,8H2
InChIKeyHRYYRLZQXLBRFY-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.21
Rot. Bonds2

About 3-(cyclopropylmethyl)-1,2-oxazol-5-amine

3-(cyclopropylmethyl)-1,2-oxazol-5-amine (PubChem CID 54776320) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-(cyclopropylmethyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(cyclopropylmethyl)-1,2-oxazol-5-amine
PubChem CID54776320
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name3-(cyclopropylmethyl)-1,2-oxazol-5-amine
SMILESNc1cc(CC2CC2)no1
InChIInChI=1S/C7H10N2O/c8-7-4-6(9-10-7)3-5-1-2-5/h4-5H,1-3,8H2
InChIKeyHRYYRLZQXLBRFY-UHFFFAOYSA-N
XLogP1.21
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(cyclopropylmethyl)-1,2-oxazol-5-amine (CID 54776320) is 3-(cyclopropylmethyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(cyclopropylmethyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(cyclopropylmethyl)-1,2-oxazol-5-amine is Nc1cc(CC2CC2)no1.
What is the InChIKey of 3-(cyclopropylmethyl)-1,2-oxazol-5-amine?
The InChIKey is HRYYRLZQXLBRFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c8-7-4-6(9-10-7)3-5-1-2-5/h4-5H,1-3,8H2.
What are the key properties of 3-(cyclopropylmethyl)-1,2-oxazol-5-amine?
3-(cyclopropylmethyl)-1,2-oxazol-5-amine has a molecular weight of 138.17 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 54776320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).