2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline

C19H20N4O — CID 3813537

IUPAC2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline
SMILESCOc1cccc(N2CCN(c3cnc4ccccc4n3)CC2)c1
InChIInChI=1S/C19H20N4O/c1-24-16-6-4-5-15(13-16)22-9-11-23(12-10-22)19-14-20-17-7-2-3-8-18(17)21-19/h2-8,13-14H,9-12H2,1H3
InChIKeyHKAXOFJWRQAGHE-UHFFFAOYSA-N
MW320.40 g/mol
LogP2.96
Rot. Bonds3

About 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline

2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline (PubChem CID 3813537) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline.

Molecular Properties

Compound Name2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline
PubChem CID3813537
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline
SMILESCOc1cccc(N2CCN(c3cnc4ccccc4n3)CC2)c1
InChIInChI=1S/C19H20N4O/c1-24-16-6-4-5-15(13-16)22-9-11-23(12-10-22)19-14-20-17-7-2-3-8-18(17)21-19/h2-8,13-14H,9-12H2,1H3
InChIKeyHKAXOFJWRQAGHE-UHFFFAOYSA-N
XLogP2.96
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(ethylamino)pyrido[3,2-d]pyrimidin-4-yl]-7-methoxy-3,4-dihydroquinoxalin-2(1H)-one
CID 156599543
4-N-(3-methoxyphenyl)pyrido[4,3-d]pyrimidine-4,7-diamine
CID 5328061
Pyrazine-Pyridine Biheteroaryl 15
CID 5330360
Pyrimidine, 2-(4-(m-methoxyphenyl)-1-piperazinyl)-
CID 198996
4-(2-chloropyrido[3,2-d]pyrimidin-4-yl)-7-methoxy-3,4-dihydroquinoxalin-2(1H)-one
CID 139592925
4-(4-Methylpiperazin-1-yl)pyrrolo[1,2-a]quinoxalin-7-ol
CID 10826756
2-chloro-N-(3-fluoro-4-methoxyphenyl)-N-methylpyrido[3,2-d]pyrimidin-4-amine
CID 164611321
6-[(2,5-dimethoxy-N-methyl-anilino)methyl]pteridine-2,4-diamine
CID 457344
2-[4-(4-Methoxyphenyl)piperazin-1-yl]quinoxaline
CID 2764806
4-(6,7-Dimethoxy-quinoxalin-2-ylamino)-cyclohexanol
CID 9796455
Benzyl-(6,7-dimethoxy-quinoxalin-2-yl)-amine
CID 9839107
N2-(3-methoxyphenyl)-N4-(quinolin-3-yl)pyrimidine-2,4-diamine
CID 9902671

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline?
The IUPAC name of 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline (CID 3813537) is 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline.
What is the SMILES notation for 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline?
The canonical SMILES for 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline is COc1cccc(N2CCN(c3cnc4ccccc4n3)CC2)c1.
What is the InChIKey of 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline?
The InChIKey is HKAXOFJWRQAGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-24-16-6-4-5-15(13-16)22-9-11-23(12-10-22)19-14-20-17-7-2-3-8-18(17)21-19/h2-8,13-14H,9-12H2,1H3.
What are the key properties of 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline?
2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline has a molecular weight of 320.40 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-methoxyphenyl)piperazin-1-yl]quinoxaline is sourced from PubChem (CID 3813537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).