1,2,3-trimethylquinoxalin-5-imine

C11H13N3 — CID 171374870

IUPAC1,2,3-trimethylquinoxalin-5-imine
SMILES[H]/N=c1\cccc2n(C)c(C)c(C)nc1-2
InChIInChI=1S/C11H13N3/c1-7-8(2)14(3)10-6-4-5-9(12)11(10)13-7/h4-6,12H,1-3H3/b12-9+
InChIKeyMFYOGMLOVPFSNH-FMIVXFBMSA-N
MW187.25 g/mol
LogP1.62
Rot. Bonds

About 1,2,3-trimethylquinoxalin-5-imine

1,2,3-trimethylquinoxalin-5-imine (PubChem CID 171374870) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 1,2,3-trimethylquinoxalin-5-imine.

Molecular Properties

Compound Name1,2,3-trimethylquinoxalin-5-imine
PubChem CID171374870
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name1,2,3-trimethylquinoxalin-5-imine
SMILES[H]/N=c1\cccc2n(C)c(C)c(C)nc1-2
InChIInChI=1S/C11H13N3/c1-7-8(2)14(3)10-6-4-5-9(12)11(10)13-7/h4-6,12H,1-3H3/b12-9+
InChIKeyMFYOGMLOVPFSNH-FMIVXFBMSA-N
XLogP1.62
TPSA41.67 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,6-Dihydrobenzo[a]quinolizin-2-imine
CID 91293056
N-propan-2-yl-3,4-dihydroquinolizin-2-imine
CID 145918539
4-imino-N,N-dimethylcyclohexa-1,5-dien-1-amine
CID 19389506
N,N,2,2-tetramethylbenzimidazol-4-amine
CID 20537751
6-diazo-N,N-diethylcyclohexa-1,3-dien-1-amine
CID 23126790
3,4-Dihydroquinolizin-2-imine
CID 57212041
5,6-diimino-1-N,1-N,3-N,3-N-tetramethylcyclohexa-1,3-diene-1,3-diamine
CID 89326013
2,4-Dimethyl-2,8-dihydroquinolizin-1-imine
CID 90985612
4,9a-Dihydroquinolizin-1-imine
CID 90992951
N,N-dimethyl-8-methylimino-4,9-dihydroquinolizin-1-amine
CID 91094632
N,N-dimethyl-8-methylimino-6,7-dihydroquinolizin-1-amine
CID 123290942
5-Imino-6-methyliminocyclohexa-1,3-dien-1-amine
CID 134275057

Frequently Asked Questions

What is the IUPAC name of 1,2,3-trimethylquinoxalin-5-imine?
The IUPAC name of 1,2,3-trimethylquinoxalin-5-imine (CID 171374870) is 1,2,3-trimethylquinoxalin-5-imine.
What is the SMILES notation for 1,2,3-trimethylquinoxalin-5-imine?
The canonical SMILES for 1,2,3-trimethylquinoxalin-5-imine is [H]/N=c1\cccc2n(C)c(C)c(C)nc1-2.
What is the InChIKey of 1,2,3-trimethylquinoxalin-5-imine?
The InChIKey is MFYOGMLOVPFSNH-FMIVXFBMSA-N. The full InChI is InChI=1S/C11H13N3/c1-7-8(2)14(3)10-6-4-5-9(12)11(10)13-7/h4-6,12H,1-3H3/b12-9+.
What are the key properties of 1,2,3-trimethylquinoxalin-5-imine?
1,2,3-trimethylquinoxalin-5-imine has a molecular weight of 187.25 g/mol, XLogP of 1.62, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-trimethylquinoxalin-5-imine is sourced from PubChem (CID 171374870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).