N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide

C16H15BrN4O — CID 171680280

IUPACN-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide
SMILESCCN(Cc1ccc(Br)cc1)C(=O)c1cnc2cnccn12
InChIInChI=1S/C16H15BrN4O/c1-2-20(11-12-3-5-13(17)6-4-12)16(22)14-9-19-15-10-18-7-8-21(14)15/h3-10H,2,11H2,1H3
InChIKeyPMKRTTOGGHLHKJ-UHFFFAOYSA-N
MW359.23 g/mol
LogP3.15
Rot. Bonds4

About N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide

N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide (PubChem CID 171680280) has the molecular formula C16H15BrN4O and a molecular weight of 359.23 g/mol. Its IUPAC name is N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide
PubChem CID171680280
Molecular FormulaC16H15BrN4O
Molecular Weight359.23 g/mol
Exact Mass358.04
IUPAC NameN-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide
SMILESCCN(Cc1ccc(Br)cc1)C(=O)c1cnc2cnccn12
InChIInChI=1S/C16H15BrN4O/c1-2-20(11-12-3-5-13(17)6-4-12)16(22)14-9-19-15-10-18-7-8-21(14)15/h3-10H,2,11H2,1H3
InChIKeyPMKRTTOGGHLHKJ-UHFFFAOYSA-N
XLogP3.15
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.23
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-dibutylimidazo[1,2-a]pyrazine-3-carboxamide
CID 171680276
imidazo[1,2-a]pyrazine-3-carboxylic acid
CID 22024617
N-benzyl-N-ethylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 110851864
N-[2-(dimethylamino)ethyl]-N-[(3-methoxyphenyl)methyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 67108105
2-[(4-bromophenyl)methylsulfanyl]-N,N-diethylacetamide
CID 967739
N-benzyl-N-(3-hydroxy-2-methylpropyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 46988612
N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]imidazo[1,2-a]pyrazine-3-carboxamide
CID 171680277
N-[(4-bromophenyl)methyl]-N-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 99176967
N-benzyl-N-ethylpyridine-3-carboxamide;hydrochloride
CID 110755487
3-chloro-N-[(3,4-difluorophenyl)methyl]-N-ethylpyridine-4-carboxamide
CID 66483932
N-[(4-bromophenyl)methyl]-1,3-diethyl-N-methylpyrazole-5-carboxamide
CID 66120211
2-[(4-bromophenyl)methyl-methylamino]pyridine-3-carboxylic acid
CID 45423294

Frequently Asked Questions

What is the IUPAC name of N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide?
The IUPAC name of N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide (CID 171680280) is N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide?
The canonical SMILES for N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide is CCN(Cc1ccc(Br)cc1)C(=O)c1cnc2cnccn12.
What is the InChIKey of N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide?
The InChIKey is PMKRTTOGGHLHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrN4O/c1-2-20(11-12-3-5-13(17)6-4-12)16(22)14-9-19-15-10-18-7-8-21(14)15/h3-10H,2,11H2,1H3.
What are the key properties of N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide?
N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide has a molecular weight of 359.23 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-bromophenyl)methyl]-N-ethylimidazo[1,2-a]pyrazine-3-carboxamide is sourced from PubChem (CID 171680280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).