1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine

C19H21N3 — CID 10851136

IUPAC1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine
SMILESCc1cc2nc(CN(C)C)c(-c3ccccc3)nc2cc1C
InChIInChI=1S/C19H21N3/c1-13-10-16-17(11-14(13)2)21-19(15-8-6-5-7-9-15)18(20-16)12-22(3)4/h5-11H,12H2,1-4H3
InChIKeyPNSQOMPTORHUJJ-UHFFFAOYSA-N
MW291.40 g/mol
LogP3.98
Rot. Bonds3

About 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine

1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine (PubChem CID 10851136) has the molecular formula C19H21N3 and a molecular weight of 291.40 g/mol. Its IUPAC name is 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine
PubChem CID10851136
Molecular FormulaC19H21N3
Molecular Weight291.40 g/mol
Exact Mass291.17
IUPAC Name1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine
SMILESCc1cc2nc(CN(C)C)c(-c3ccccc3)nc2cc1C
InChIInChI=1S/C19H21N3/c1-13-10-16-17(11-14(13)2)21-19(15-8-6-5-7-9-15)18(20-16)12-22(3)4/h5-11H,12H2,1-4H3
InChIKeyPNSQOMPTORHUJJ-UHFFFAOYSA-N
XLogP3.98
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine (CID 10851136) is 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine is Cc1cc2nc(CN(C)C)c(-c3ccccc3)nc2cc1C.
What is the InChIKey of 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine?
The InChIKey is PNSQOMPTORHUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3/c1-13-10-16-17(11-14(13)2)21-19(15-8-6-5-7-9-15)18(20-16)12-22(3)4/h5-11H,12H2,1-4H3.
What are the key properties of 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine?
1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine has a molecular weight of 291.40 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 10851136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).