2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline

C11H11N3 — CID 45115659

IUPAC2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline
SMILESC1=Nc2ccccc2N2CCCN=C12
InChIInChI=1S/C11H11N3/c1-2-5-10-9(4-1)13-8-11-12-6-3-7-14(10)11/h1-2,4-5,8H,3,6-7H2
InChIKeyQNYURDSBIFJURG-UHFFFAOYSA-N
MW185.23 g/mol
LogP2.01
Rot. Bonds

About 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline

2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline (PubChem CID 45115659) has the molecular formula C11H11N3 and a molecular weight of 185.23 g/mol. Its IUPAC name is 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline.

Molecular Properties

Compound Name2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline
PubChem CID45115659
Molecular FormulaC11H11N3
Molecular Weight185.23 g/mol
Exact Mass185.10
IUPAC Name2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline
SMILESC1=Nc2ccccc2N2CCCN=C12
InChIInChI=1S/C11H11N3/c1-2-5-10-9(4-1)13-8-11-12-6-3-7-14(10)11/h1-2,4-5,8H,3,6-7H2
InChIKeyQNYURDSBIFJURG-UHFFFAOYSA-N
XLogP2.01
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-(1-piperidinyl) aniline
CID 22493274
1,2,3,3a-Tetrahydro-pyrrolo[1,2-a]quinoxalin-4-ylamine
CID 44320114
4-Piperazin-1-yl-1,2-dihydroimidazo[1,2-a]quinoxaline;hydrochloride
CID 49860758
N-(2-piperidin-1-ylphenyl)-3,4-dihydro-2H-pyrrol-5-amine;hydrochloride
CID 6602858
5-methyl-6-oxido-2,3-dihydro-1H-pyrimido[1,2-a]quinoxalin-6-ium
CID 11447233
Agn-PC-0ojiye
CID 12210157
2(1H)-Quinoxalinethione, 1-methyl-
CID 351426
2-(3,4-Dihydroquinoxalin-2-yl)guanidine
CID 91663467
1,3-Diphenyl-4,5-dihydroimidazol-1-ium
CID 421264
Phenylimidazoline
CID 12107246
1-Phenyl-4,4-dimethyl imidazoline
CID 12386889
2-Methyl-1-phenyl-4,5-dihydro-1H-imidazole
CID 14089319

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline?
The IUPAC name of 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline (CID 45115659) is 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline.
What is the SMILES notation for 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline?
The canonical SMILES for 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline is C1=Nc2ccccc2N2CCCN=C12.
What is the InChIKey of 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline?
The InChIKey is QNYURDSBIFJURG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3/c1-2-5-10-9(4-1)13-8-11-12-6-3-7-14(10)11/h1-2,4-5,8H,3,6-7H2.
What are the key properties of 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline?
2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline has a molecular weight of 185.23 g/mol, XLogP of 2.01, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-pyrimido[1,2-a]quinoxaline is sourced from PubChem (CID 45115659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).