2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide

C24H19Cl2N3O4 — CID 20994575

IUPAC2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide
SMILESCOc1ccc(C(=O)c2c(N)c(C(=O)Nc3cc(Cl)cc(Cl)c3)c3ccccn23)cc1OC
InChIInChI=1S/C24H19Cl2N3O4/c1-32-18-7-6-13(9-19(18)33-2)23(30)22-21(27)20(17-5-3-4-8-29(17)22)24(31)28-16-11-14(25)10-15(26)12-16/h3-12H,27H2,1-2H3,(H,28,31)
InChIKeySWAZXPOGZKGYLM-UHFFFAOYSA-N
MW484.34 g/mol
LogP5.33
Rot. Bonds6

About 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide

2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide (PubChem CID 20994575) has the molecular formula C24H19Cl2N3O4 and a molecular weight of 484.34 g/mol. Its IUPAC name is 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide
PubChem CID20994575
Molecular FormulaC24H19Cl2N3O4
Molecular Weight484.34 g/mol
Exact Mass483.08
IUPAC Name2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide
SMILESCOc1ccc(C(=O)c2c(N)c(C(=O)Nc3cc(Cl)cc(Cl)c3)c3ccccn23)cc1OC
InChIInChI=1S/C24H19Cl2N3O4/c1-32-18-7-6-13(9-19(18)33-2)23(30)22-21(27)20(17-5-3-4-8-29(17)22)24(31)28-16-11-14(25)10-15(26)12-16/h3-12H,27H2,1-2H3,(H,28,31)
InChIKeySWAZXPOGZKGYLM-UHFFFAOYSA-N
XLogP5.33
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.34
LogP ≤ 55.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-3-(3,4-dimethoxybenzoyl)-N-(2-methoxyphenyl)indolizine-1-carboxamide
CID 20994572
2-amino-3-(3,4-dimethylbenzoyl)-N-(3,4-dimethylphenyl)indolizine-1-carboxamide
CID 16955584
2-amino-N-(3-chlorophenyl)-3-(4-fluorobenzoyl)indolizine-1-carboxamide
CID 18576467
2-amino-N-(4-chlorophenyl)-3-(4-fluorobenzoyl)indolizine-1-carboxamide
CID 7294632
2-amino-3-benzoyl-N-(3,4-dichlorophenyl)indolizine-1-carboxamide
CID 18576462
2-amino-3-(4-methoxybenzoyl)indolizine-1-carboxamide
CID 177255832
2-amino-N-(4-bromophenyl)-3-(4-fluorobenzoyl)indolizine-1-carboxamide
CID 18576437
[2-(3,5-dichloroanilino)-2-oxoethyl] 3,4-dimethoxybenzoate
CID 1191663
3-[(3,5-dichlorophenyl)carbamoyl-sulfanylamino]-4-methoxy-N-phenylbenzamide
CID 57257525
N-(3,5-dichlorophenyl)-3-fluoro-4-methoxybenzamide
CID 27844181
N-[3-[1-(3,5-dichloroanilino)-1-oxopropan-2-yl]sulfanylphenyl]-3,4-dimethoxybenzamide
CID 18902675
N-(3,5-dichlorophenyl)-3,5-dimethoxy-4-methylbenzamide
CID 4830381

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide?
The IUPAC name of 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide (CID 20994575) is 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide.
What is the SMILES notation for 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide?
The canonical SMILES for 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide is COc1ccc(C(=O)c2c(N)c(C(=O)Nc3cc(Cl)cc(Cl)c3)c3ccccn23)cc1OC.
What is the InChIKey of 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide?
The InChIKey is SWAZXPOGZKGYLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19Cl2N3O4/c1-32-18-7-6-13(9-19(18)33-2)23(30)22-21(27)20(17-5-3-4-8-29(17)22)24(31)28-16-11-14(25)10-15(26)12-16/h3-12H,27H2,1-2H3,(H,28,31).
What are the key properties of 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide?
2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide has a molecular weight of 484.34 g/mol, XLogP of 5.33, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-dichlorophenyl)-3-(3,4-dimethoxybenzoyl)indolizine-1-carboxamide is sourced from PubChem (CID 20994575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).