2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide

C19H19Cl2N3O2 — CID 97068947

IUPAC2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide
SMILESC[C@H](NC(=O)Cc1cn2cc(Cl)cc(Cl)c2n1)[C@@H](O)Cc1ccccc1
InChIInChI=1S/C19H19Cl2N3O2/c1-12(17(25)7-13-5-3-2-4-6-13)22-18(26)9-15-11-24-10-14(20)8-16(21)19(24)23-15/h2-6,8,10-12,17,25H,7,9H2,1H3,(H,22,26)/t12-,17-/m0/s1
InChIKeyWZPQEXYMUAWHCM-SJCJKPOMSA-N
MW392.29 g/mol
LogP3.29
Rot. Bonds6

About 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide

2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide (PubChem CID 97068947) has the molecular formula C19H19Cl2N3O2 and a molecular weight of 392.29 g/mol. Its IUPAC name is 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide.

Molecular Properties

Compound Name2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide
PubChem CID97068947
Molecular FormulaC19H19Cl2N3O2
Molecular Weight392.29 g/mol
Exact Mass391.09
IUPAC Name2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide
SMILESC[C@H](NC(=O)Cc1cn2cc(Cl)cc(Cl)c2n1)[C@@H](O)Cc1ccccc1
InChIInChI=1S/C19H19Cl2N3O2/c1-12(17(25)7-13-5-3-2-4-6-13)22-18(26)9-15-11-24-10-14(20)8-16(21)19(24)23-15/h2-6,8,10-12,17,25H,7,9H2,1H3,(H,22,26)/t12-,17-/m0/s1
InChIKeyWZPQEXYMUAWHCM-SJCJKPOMSA-N
XLogP3.29
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.29
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethyl]acetamide
CID 71873152
N-(3-hydroxy-4-phenylbutan-2-yl)-2-(4-phenylphenyl)acetamide
CID 75386489
3-[[2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)acetyl]-methylamino]propanoic acid
CID 119362699
N-[3,4-bis(4-chlorophenyl)butan-2-yl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 23404768
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2R,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide
CID 99825884
2-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)acetohydrazide
CID 82530675
N-[2-(3-but-3-ynyldiazirin-3-yl)ethyl]-2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)acetamide
CID 167860410
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propanoic acid
CID 43355303
3-hydroxy-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid
CID 43353673
2-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrochloride
CID 82530799
tert-butyl N-[(2R,3S)-3-hydroxy-4-phenylbutan-2-yl]carbamate
CID 96581873
2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-1-[3-(methylamino)piperidin-1-yl]ethanone
CID 119490476

Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide?
The IUPAC name of 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide (CID 97068947) is 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide.
What is the SMILES notation for 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide?
The canonical SMILES for 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide is C[C@H](NC(=O)Cc1cn2cc(Cl)cc(Cl)c2n1)[C@@H](O)Cc1ccccc1.
What is the InChIKey of 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide?
The InChIKey is WZPQEXYMUAWHCM-SJCJKPOMSA-N. The full InChI is InChI=1S/C19H19Cl2N3O2/c1-12(17(25)7-13-5-3-2-4-6-13)22-18(26)9-15-11-24-10-14(20)8-16(21)19(24)23-15/h2-6,8,10-12,17,25H,7,9H2,1H3,(H,22,26)/t12-,17-/m0/s1.
What are the key properties of 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide?
2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide has a molecular weight of 392.29 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)-N-[(2S,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide is sourced from PubChem (CID 97068947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).