2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide

C22H21Cl2N5O — CID 71873152

IUPAC2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide
SMILESCc1cc(C)n(-c2ccc(C(C)NC(=O)Cc3cn4cc(Cl)cc(Cl)c4n3)cc2)n1
InChIInChI=1S/C22H21Cl2N5O/c1-13-8-14(2)29(27-13)19-6-4-16(5-7-19)15(3)25-21(30)10-18-12-28-11-17(23)9-20(24)22(28)26-18/h4-9,11-12,15H,10H2,1-3H3,(H,25,30)
InChIKeyKMSYLYYJDWQUGB-UHFFFAOYSA-N
MW442.35 g/mol
LogP4.86
Rot. Bonds5

About 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide

2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide (PubChem CID 71873152) has the molecular formula C22H21Cl2N5O and a molecular weight of 442.35 g/mol. Its IUPAC name is 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide.

Molecular Properties

Compound Name2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide
PubChem CID71873152
Molecular FormulaC22H21Cl2N5O
Molecular Weight442.35 g/mol
Exact Mass441.11
IUPAC Name2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide
SMILESCc1cc(C)n(-c2ccc(C(C)NC(=O)Cc3cn4cc(Cl)cc(Cl)c4n3)cc2)n1
InChIInChI=1S/C22H21Cl2N5O/c1-13-8-14(2)29(27-13)19-6-4-16(5-7-19)15(3)25-21(30)10-18-12-28-11-17(23)9-20(24)22(28)26-18/h4-9,11-12,15H,10H2,1-3H3,(H,25,30)
InChIKeyKMSYLYYJDWQUGB-UHFFFAOYSA-N
XLogP4.86
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.35
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]pentanamide
CID 120565817
4-amino-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]butanamide
CID 119894668
2-(cyclopropylmethylamino)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide
CID 119894640
N-[(1S)-1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-2-imidazol-1-ylacetamide
CID 97031370
1-[[(1S)-1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 124591003
3-amino-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-2-methylbutanamide;dihydrochloride
CID 120504201
(2S)-N-[(1R)-1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-2-methylsulfonylpropanamide
CID 95971898
(2R)-N-[(1R)-1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-2-imidazol-1-ylpropanamide
CID 96570122
N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]-3-(3-fluoro-4-methoxyphenyl)propanamide
CID 71873153
(2R)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]piperidine-2-carboxamide;dihydrochloride
CID 119894609
2-[[1-(2,4-dichlorophenyl)-5-methylpyrazol-3-yl]amino]-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 166342994
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]acetamide
CID 25351863

Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide?
The IUPAC name of 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide (CID 71873152) is 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide.
What is the SMILES notation for 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide?
The canonical SMILES for 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide is Cc1cc(C)n(-c2ccc(C(C)NC(=O)Cc3cn4cc(Cl)cc(Cl)c4n3)cc2)n1.
What is the InChIKey of 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide?
The InChIKey is KMSYLYYJDWQUGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21Cl2N5O/c1-13-8-14(2)29(27-13)19-6-4-16(5-7-19)15(3)25-21(30)10-18-12-28-11-17(23)9-20(24)22(28)26-18/h4-9,11-12,15H,10H2,1-3H3,(H,25,30).
What are the key properties of 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide?
2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide has a molecular weight of 442.35 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide is sourced from PubChem (CID 71873152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).