4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide

C23H27N5O4 — CID 54154885

IUPAC4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide
SMILESCOc1cc(OC)cc(N2CCN(C(=O)N(C)c3nc4ccccc4nc3OC)CC2)c1
InChIInChI=1S/C23H27N5O4/c1-26(21-22(32-4)25-20-8-6-5-7-19(20)24-21)23(29)28-11-9-27(10-12-28)16-13-17(30-2)15-18(14-16)31-3/h5-8,13-15H,9-12H2,1-4H3
InChIKeyOKIFESCBUXDLES-UHFFFAOYSA-N
MW437.50 g/mol
LogP3.03
Rot. Bonds5

About 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide

4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide (PubChem CID 54154885) has the molecular formula C23H27N5O4 and a molecular weight of 437.50 g/mol. Its IUPAC name is 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide
PubChem CID54154885
Molecular FormulaC23H27N5O4
Molecular Weight437.50 g/mol
Exact Mass437.21
IUPAC Name4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide
SMILESCOc1cc(OC)cc(N2CCN(C(=O)N(C)c3nc4ccccc4nc3OC)CC2)c1
InChIInChI=1S/C23H27N5O4/c1-26(21-22(32-4)25-20-8-6-5-7-19(20)24-21)23(29)28-11-9-27(10-12-28)16-13-17(30-2)15-18(14-16)31-3/h5-8,13-15H,9-12H2,1-4H3
InChIKeyOKIFESCBUXDLES-UHFFFAOYSA-N
XLogP3.03
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.50
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

4-(3,5-dinitrophenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide
CID 86588089
4-(3,5-dimethoxyphenyl)-N-(3,7-dimethoxyquinoxalin-2-yl)piperazine-1-carboxamide
CID 69243350
4-(3,5-dimethylphenyl)-N-[1-(3-methoxyquinoxalin-2-yl)ethyl]piperazine-1-carboxamide
CID 23446229
4-(3,5-dimethoxyphenyl)-N-(3-methoxy-6-methylquinoxalin-2-yl)piperazine-1-carboxamide
CID 69244400
2-(3,5-dimethoxyphenoxy)-1-(4-phenylpiperazin-1-yl)propan-1-one
CID 17395855
4-(3,5-dinitrophenyl)-N-(3-methoxy-5,6-dimethylpyrazin-2-yl)-N-methylpiperazine-1-carboxamide;4-(3,5-dinitrophenyl)-N-(3-methoxy-5,6-dimethylpyrazin-2-yl)piperazine-1-carboxamide
CID 158870076
N-methyl-N,4-diphenylpiperazine-1-carboxamide
CID 890140
4-(3,5-dimethylphenyl)-N-[2-(3-methoxyquinoxalin-2-yl)ethyl]piperazine-1-carboxamide
CID 91601033
2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-methyl-2-oxo-N-phenylacetamide
CID 108986682
[4-(4-methoxyphenyl)piperazin-1-yl]-quinoxalin-2-ylmethanone
CID 18192931
1-[(2S)-1-[4-(3-methoxyphenyl)piperazin-1-yl]-1-oxopropan-2-yl]-3-(trifluoromethyl)quinoxalin-2-one
CID 92864964
[4-(3-methoxyphenyl)piperazin-1-yl]-quinolin-2-ylmethanone
CID 2023384

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide?
The IUPAC name of 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide (CID 54154885) is 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide?
The canonical SMILES for 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide is COc1cc(OC)cc(N2CCN(C(=O)N(C)c3nc4ccccc4nc3OC)CC2)c1.
What is the InChIKey of 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide?
The InChIKey is OKIFESCBUXDLES-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O4/c1-26(21-22(32-4)25-20-8-6-5-7-19(20)24-21)23(29)28-11-9-27(10-12-28)16-13-17(30-2)15-18(14-16)31-3/h5-8,13-15H,9-12H2,1-4H3.
What are the key properties of 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide?
4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide has a molecular weight of 437.50 g/mol, XLogP of 3.03, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethoxyphenyl)-N-(3-methoxyquinoxalin-2-yl)-N-methylpiperazine-1-carboxamide is sourced from PubChem (CID 54154885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).