N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine

C7H11N3O — CID 123763792

IUPACN,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine
SMILESC=C(c1noc(C)n1)N(C)C
InChIInChI=1S/C7H11N3O/c1-5(10(3)4)7-8-6(2)11-9-7/h1H2,2-4H3
InChIKeyOOLPAKDRPUQKGB-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.91
Rot. Bonds2

About N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine

N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine (PubChem CID 123763792) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine
PubChem CID123763792
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC NameN,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine
SMILESC=C(c1noc(C)n1)N(C)C
InChIInChI=1S/C7H11N3O/c1-5(10(3)4)7-8-6(2)11-9-7/h1H2,2-4H3
InChIKeyOOLPAKDRPUQKGB-UHFFFAOYSA-N
XLogP0.91
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

bis(5-methyl-1,2,4-oxadiazol-3-yl)methanone
CID 90843715
3-[(3E)-2,6-dimethylhepta-1,3,5-trien-4-yl]-5-methyl-1,2,4-oxadiazole
CID 138534842
3-but-2-en-2-yl-5-methyl-1,2,4-oxadiazole
CID 123960870
lithium 5-methyl-1,2,4-oxadiazole-3-carboxylate
CID 134690810
1-(5-methyl-1,2,4-oxadiazol-3-yl)propan-1-one
CID 142391615
N-(4-aminocyclohexyl)-N,5-dimethyl-1,2,4-oxadiazole-3-carboxamide
CID 79121057
N-(3-amino-2,2-dimethylpropyl)-N,5-dimethyl-1,2,4-oxadiazole-3-carboxamide
CID 79653066
N'-amino-N-methyl-N-[1-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]ethenyl]ethanimidamide
CID 145294744
3-[(3E,6Z)-8-fluoroocta-1,3,6-trien-4-yl]-5-methyl-1,2,4-oxadiazole
CID 142816300
N,2,2-trimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propanamide
CID 136542412
(E)-2-(5-methyl-1,2,4-oxadiazol-3-yl)-2-pyrimidin-5-ylethenol
CID 168984105
3-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]but-3-en-1-amine
CID 106416031

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine?
The IUPAC name of N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine (CID 123763792) is N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine.
What is the SMILES notation for N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine?
The canonical SMILES for N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine is C=C(c1noc(C)n1)N(C)C.
What is the InChIKey of N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine?
The InChIKey is OOLPAKDRPUQKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-5(10(3)4)7-8-6(2)11-9-7/h1H2,2-4H3.
What are the key properties of N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine?
N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine has a molecular weight of 153.18 g/mol, XLogP of 0.91, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethenamine is sourced from PubChem (CID 123763792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).