3-chloro-N,7-dimethylquinoxalin-2-amine

C10H10ClN3 — CID 175634550

IUPAC3-chloro-N,7-dimethylquinoxalin-2-amine
SMILESCNc1nc2cc(C)ccc2nc1Cl
InChIInChI=1S/C10H10ClN3/c1-6-3-4-7-8(5-6)14-10(12-2)9(11)13-7/h3-5H,1-2H3,(H,12,14)
InChIKeyFYDUHKGSSQCPPY-UHFFFAOYSA-N
MW207.66 g/mol
LogP2.63
Rot. Bonds1

About 3-chloro-N,7-dimethylquinoxalin-2-amine

3-chloro-N,7-dimethylquinoxalin-2-amine (PubChem CID 175634550) has the molecular formula C10H10ClN3 and a molecular weight of 207.66 g/mol. Its IUPAC name is 3-chloro-N,7-dimethylquinoxalin-2-amine.

Molecular Properties

Compound Name3-chloro-N,7-dimethylquinoxalin-2-amine
PubChem CID175634550
Molecular FormulaC10H10ClN3
Molecular Weight207.66 g/mol
Exact Mass207.06
IUPAC Name3-chloro-N,7-dimethylquinoxalin-2-amine
SMILESCNc1nc2cc(C)ccc2nc1Cl
InChIInChI=1S/C10H10ClN3/c1-6-3-4-7-8(5-6)14-10(12-2)9(11)13-7/h3-5H,1-2H3,(H,12,14)
InChIKeyFYDUHKGSSQCPPY-UHFFFAOYSA-N
XLogP2.63
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.66
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N,7-dimethylquinoxalin-2-amine?
The IUPAC name of 3-chloro-N,7-dimethylquinoxalin-2-amine (CID 175634550) is 3-chloro-N,7-dimethylquinoxalin-2-amine.
What is the SMILES notation for 3-chloro-N,7-dimethylquinoxalin-2-amine?
The canonical SMILES for 3-chloro-N,7-dimethylquinoxalin-2-amine is CNc1nc2cc(C)ccc2nc1Cl.
What is the InChIKey of 3-chloro-N,7-dimethylquinoxalin-2-amine?
The InChIKey is FYDUHKGSSQCPPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3/c1-6-3-4-7-8(5-6)14-10(12-2)9(11)13-7/h3-5H,1-2H3,(H,12,14).
What are the key properties of 3-chloro-N,7-dimethylquinoxalin-2-amine?
3-chloro-N,7-dimethylquinoxalin-2-amine has a molecular weight of 207.66 g/mol, XLogP of 2.63, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N,7-dimethylquinoxalin-2-amine is sourced from PubChem (CID 175634550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).