5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine

C7H14N2O — CID 74999666

IUPAC5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine
SMILESCCCC1N=C(N)OC1C
InChIInChI=1S/C7H14N2O/c1-3-4-6-5(2)10-7(8)9-6/h5-6H,3-4H2,1-2H3,(H2,8,9)
InChIKeyPKWLPWWYKVMMNO-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.89
Rot. Bonds2

About 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine

5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine (PubChem CID 74999666) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine
PubChem CID74999666
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine
SMILESCCCC1N=C(N)OC1C
InChIInChI=1S/C7H14N2O/c1-3-4-6-5(2)10-7(8)9-6/h5-6H,3-4H2,1-2H3,(H2,8,9)
InChIKeyPKWLPWWYKVMMNO-UHFFFAOYSA-N
XLogP0.89
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine?
The IUPAC name of 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine (CID 74999666) is 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine.
What is the SMILES notation for 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine?
The canonical SMILES for 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine is CCCC1N=C(N)OC1C.
What is the InChIKey of 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine?
The InChIKey is PKWLPWWYKVMMNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-3-4-6-5(2)10-7(8)9-6/h5-6H,3-4H2,1-2H3,(H2,8,9).
What are the key properties of 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine?
5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine has a molecular weight of 142.20 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-propyl-4,5-dihydro-1,3-oxazol-2-amine is sourced from PubChem (CID 74999666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).