3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine

C5H9N3O — CID 83863959

IUPAC3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine
SMILESCN(C)c1cc(N)on1
InChIInChI=1S/C5H9N3O/c1-8(2)5-3-4(6)9-7-5/h3H,6H2,1-2H3
InChIKeyOLKBAJQZEGUTDB-UHFFFAOYSA-N
MW127.15 g/mol
LogP0.32
Rot. Bonds1

About 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine

3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine (PubChem CID 83863959) has the molecular formula C5H9N3O and a molecular weight of 127.15 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine
PubChem CID83863959
Molecular FormulaC5H9N3O
Molecular Weight127.15 g/mol
Exact Mass127.07
IUPAC Name3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine
SMILESCN(C)c1cc(N)on1
InChIInChI=1S/C5H9N3O/c1-8(2)5-3-4(6)9-7-5/h3H,6H2,1-2H3
InChIKeyOLKBAJQZEGUTDB-UHFFFAOYSA-N
XLogP0.32
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.15
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-1,2-oxazol-5-amine
CID 10866295
3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine
CID 117309650
3-[3-(dimethylamino)-4-methylphenyl]-1,2-oxazol-5-amine
CID 115112364
3-tert-butyl-1,2-oxazol-5-amine;hydrochloride
CID 20847937
3-propyl-1,2-oxazol-5-amine
CID 2104061
2-N,2-N,4-trimethylpyridine-2,5-diamine;trihydrochloride
CID 129319878
4-N,4-N-dimethylpyrimidine-2,4,6-triamine
CID 23423800
(5-amino-1,2-oxazol-3-yl)-methylsulfonylmethanone
CID 117214997
3-(2,3,4,5,6-pentafluorophenyl)-1,2-oxazol-5-amine
CID 43608008
3-[(1S)-1-cyclopropylethyl]-1,2-oxazol-5-amine
CID 124599309
3-(5-methylfuran-2-yl)-1,2-oxazol-5-amine
CID 28780619
3-(1-amino-3-methylbutyl)-1,2-oxazol-5-amine
CID 112710409

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine?
The IUPAC name of 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine (CID 83863959) is 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine is CN(C)c1cc(N)on1.
What is the InChIKey of 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine?
The InChIKey is OLKBAJQZEGUTDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O/c1-8(2)5-3-4(6)9-7-5/h3H,6H2,1-2H3.
What are the key properties of 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine?
3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine has a molecular weight of 127.15 g/mol, XLogP of 0.32, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine is sourced from PubChem (CID 83863959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).