N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide

C15H12Cl2N4O — CID 171680237

IUPACN-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide
SMILESCC(NC(=O)c1cnc2cnccn12)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C15H12Cl2N4O/c1-9(10-2-3-11(16)12(17)6-10)20-15(22)13-7-19-14-8-18-4-5-21(13)14/h2-9H,1H3,(H,20,22)
InChIKeyGZIKJLOYXWSROC-UHFFFAOYSA-N
MW335.19 g/mol
LogP3.53
Rot. Bonds3

About N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide

N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide (PubChem CID 171680237) has the molecular formula C15H12Cl2N4O and a molecular weight of 335.19 g/mol. Its IUPAC name is N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide
PubChem CID171680237
Molecular FormulaC15H12Cl2N4O
Molecular Weight335.19 g/mol
Exact Mass334.04
IUPAC NameN-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide
SMILESCC(NC(=O)c1cnc2cnccn12)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C15H12Cl2N4O/c1-9(10-2-3-11(16)12(17)6-10)20-15(22)13-7-19-14-8-18-4-5-21(13)14/h2-9H,1H3,(H,20,22)
InChIKeyGZIKJLOYXWSROC-UHFFFAOYSA-N
XLogP3.53
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.19
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(3-chlorophenyl)-2,2,2-trifluoroethyl]imidazo[1,2-a]pyrazine-3-carboxamide
CID 171680250
2-(aminomethyl)-N-[1-(3,4-dichlorophenyl)ethyl]pyridine-4-carboxamide
CID 114326268
N-[(1R)-1-(3,4-dichlorophenyl)ethyl]benzamide
CID 793526
5-chloro-N-[1-(3,4-dichlorophenyl)ethyl]-2-fluorobenzamide
CID 60674629
5-bromo-N-[1-(3,4-dichlorophenyl)ethyl]thiophene-2-carboxamide
CID 60629480
N-[1-(3,4-dichlorophenyl)ethyl]-2-fluoro-5-methylbenzamide
CID 62513333
N-[1-(3,4-dichlorophenyl)ethyl]-2,2,2-trifluoroacetamide
CID 62490766
2-[[2-[[(1R)-1-(3,4-dichlorophenyl)ethyl]amino]-2-oxoethyl]amino]-N-methylacetamide
CID 8772386
4-amino-N-[1-(3,4-dichlorophenyl)ethyl]-3-methylbenzamide
CID 61249263
3-bromo-5-chloro-N-[1-(3,4-dichlorophenyl)ethyl]benzamide
CID 107951762
N-[(1R)-1-(3,4-dichlorophenyl)ethyl]cyclopropanecarboxamide
CID 31462274
1-(2-aminoethyl)-N-[1-(3,4-dichlorophenyl)ethyl]imidazole-4-carboxamide
CID 107497624

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide?
The IUPAC name of N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide (CID 171680237) is N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide?
The canonical SMILES for N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide is CC(NC(=O)c1cnc2cnccn12)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide?
The InChIKey is GZIKJLOYXWSROC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N4O/c1-9(10-2-3-11(16)12(17)6-10)20-15(22)13-7-19-14-8-18-4-5-21(13)14/h2-9H,1H3,(H,20,22).
What are the key properties of N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide?
N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide has a molecular weight of 335.19 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,4-dichlorophenyl)ethyl]imidazo[1,2-a]pyrazine-3-carboxamide is sourced from PubChem (CID 171680237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).