N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide

C19H19BrN4O2 — CID 27761624

IUPACN-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1cc(Br)ccc1NC(=O)CN(C)C(=O)c1cn2c(C)cccc2n1
InChIInChI=1S/C19H19BrN4O2/c1-12-9-14(20)7-8-15(12)22-18(25)11-23(3)19(26)16-10-24-13(2)5-4-6-17(24)21-16/h4-10H,11H2,1-3H3,(H,22,25)
InChIKeyIZRFCWJDZFXONF-UHFFFAOYSA-N
MW415.29 g/mol
LogP3.42
Rot. Bonds4

About N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide

N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 27761624) has the molecular formula C19H19BrN4O2 and a molecular weight of 415.29 g/mol. Its IUPAC name is N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID27761624
Molecular FormulaC19H19BrN4O2
Molecular Weight415.29 g/mol
Exact Mass414.07
IUPAC NameN-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1cc(Br)ccc1NC(=O)CN(C)C(=O)c1cn2c(C)cccc2n1
InChIInChI=1S/C19H19BrN4O2/c1-12-9-14(20)7-8-15(12)22-18(25)11-23(3)19(26)16-10-24-13(2)5-4-6-17(24)21-16/h4-10H,11H2,1-3H3,(H,22,25)
InChIKeyIZRFCWJDZFXONF-UHFFFAOYSA-N
XLogP3.42
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.29
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethyl-1-phenylpyrazole-3-carboxamide
CID 55757786
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,2,3-trimethylbenzamide
CID 26904815
N-(4-bromo-2-methylphenyl)-2-[methyl-(2-methylsulfanylacetyl)amino]acetamide
CID 17407334
5-bromo-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-chloro-N-methylbenzamide
CID 26904812
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-fluoro-N-methylbenzamide
CID 8698305
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N-methyl-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide
CID 55786527
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3,6-dichloro-N-methylpyridine-2-carboxamide
CID 26904882
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,3-dimethylthiophene-2-carboxamide
CID 27761650
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-fluoro-N,3-dimethyl-1-benzothiophene-2-carboxamide
CID 24543825
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N-methyl-1-(2-methylpropyl)indole-3-carboxamide
CID 55914201
3-acetamido-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N-methylpropanamide
CID 16583098
N-(4-bromo-2-methylphenyl)-2-[methyl(naphthalen-2-ylcarbamoyl)amino]acetamide
CID 78871865

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide (CID 27761624) is N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide is Cc1cc(Br)ccc1NC(=O)CN(C)C(=O)c1cn2c(C)cccc2n1.
What is the InChIKey of N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is IZRFCWJDZFXONF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19BrN4O2/c1-12-9-14(20)7-8-15(12)22-18(25)11-23(3)19(26)16-10-24-13(2)5-4-6-17(24)21-16/h4-10H,11H2,1-3H3,(H,22,25).
What are the key properties of N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide?
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 415.29 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,5-dimethylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 27761624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).