N,1,3,6,7-pentamethylquinoxalin-2-imine

C13H17N3 — CID 142206053

IUPACN,1,3,6,7-pentamethylquinoxalin-2-imine
SMILESC/N=c1\c(C)nc2cc(C)c(C)cc2n1C
InChIInChI=1S/C13H17N3/c1-8-6-11-12(7-9(8)2)16(5)13(14-4)10(3)15-11/h6-7H,1-5H3/b14-13+
InChIKeyZGHFNAPRWSDXBW-BUHFOSPRSA-N
MW215.30 g/mol
LogP2.03
Rot. Bonds

About N,1,3,6,7-pentamethylquinoxalin-2-imine

N,1,3,6,7-pentamethylquinoxalin-2-imine (PubChem CID 142206053) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is N,1,3,6,7-pentamethylquinoxalin-2-imine.

Molecular Properties

Compound NameN,1,3,6,7-pentamethylquinoxalin-2-imine
PubChem CID142206053
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC NameN,1,3,6,7-pentamethylquinoxalin-2-imine
SMILESC/N=c1\c(C)nc2cc(C)c(C)cc2n1C
InChIInChI=1S/C13H17N3/c1-8-6-11-12(7-9(8)2)16(5)13(14-4)10(3)15-11/h6-7H,1-5H3/b14-13+
InChIKeyZGHFNAPRWSDXBW-BUHFOSPRSA-N
XLogP2.03
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

formaldehyde;N-methylethenamine;N,1,3,6,7-pentamethylquinoxalin-2-imine
CID 142206052
1,5,6-trimethylbenzimidazol-2-amine;hydrochloride
CID 72710310
4-(2-aminoethyl)-6,7-dimethyl-3-methyliminoquinoxaline-2-carbaldehyde
CID 131978086
2-(2-chloroethyl)-1,5,6-trimethylbenzimidazole
CID 100587289
N-[(1,5,6-trimethylbenzimidazol-2-yl)methyl]ethanamine
CID 46785621
4,6,7-trimethyl-3-oxoquinoxaline-2-carboxamide
CID 175952260
6-fluoro-1,2,5-trimethylbenzimidazole
CID 123239325
2-(1,5,6-trimethylbenzimidazol-2-yl)sulfanylpropan-1-amine
CID 84617059
ethane;2,3,6-trimethylbenzimidazol-5-ol
CID 168977189
2,5,6-trimethyl-1-propylbenzimidazole
CID 23609987
7,8,10-trimethyl-4-sulfanylidenebenzo[g]pteridin-2-one
CID 102221390
2-methyl-3-(1,5,6-trimethylbenzimidazol-2-yl)sulfanylpropanethioamide
CID 84617075

Frequently Asked Questions

What is the IUPAC name of N,1,3,6,7-pentamethylquinoxalin-2-imine?
The IUPAC name of N,1,3,6,7-pentamethylquinoxalin-2-imine (CID 142206053) is N,1,3,6,7-pentamethylquinoxalin-2-imine.
What is the SMILES notation for N,1,3,6,7-pentamethylquinoxalin-2-imine?
The canonical SMILES for N,1,3,6,7-pentamethylquinoxalin-2-imine is C/N=c1\c(C)nc2cc(C)c(C)cc2n1C.
What is the InChIKey of N,1,3,6,7-pentamethylquinoxalin-2-imine?
The InChIKey is ZGHFNAPRWSDXBW-BUHFOSPRSA-N. The full InChI is InChI=1S/C13H17N3/c1-8-6-11-12(7-9(8)2)16(5)13(14-4)10(3)15-11/h6-7H,1-5H3/b14-13+.
What are the key properties of N,1,3,6,7-pentamethylquinoxalin-2-imine?
N,1,3,6,7-pentamethylquinoxalin-2-imine has a molecular weight of 215.30 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3,6,7-pentamethylquinoxalin-2-imine is sourced from PubChem (CID 142206053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).