N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide

C15H15N3O2S — CID 82367473

IUPACN-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(-c2nc3n(c2C=O)CCS3)cc1
InChIInChI=1S/C15H15N3O2S/c1-2-13(20)16-11-5-3-10(4-6-11)14-12(9-19)18-7-8-21-15(18)17-14/h3-6,9H,2,7-8H2,1H3,(H,16,20)
InChIKeyFIRZGSAGQBHVHH-UHFFFAOYSA-N
MW301.37 g/mol
LogP2.82
Rot. Bonds4

About N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide

N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide (PubChem CID 82367473) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide.

Molecular Properties

Compound NameN-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide
PubChem CID82367473
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC NameN-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(-c2nc3n(c2C=O)CCS3)cc1
InChIInChI=1S/C15H15N3O2S/c1-2-13(20)16-11-5-3-10(4-6-11)14-12(9-19)18-7-8-21-15(18)17-14/h3-6,9H,2,7-8H2,1H3,(H,16,20)
InChIKeyFIRZGSAGQBHVHH-UHFFFAOYSA-N
XLogP2.82
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[4-[5-(aminomethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]phenyl]propanamide
CID 82367581
N-[[6-(4-methylphenyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl]methyl]acetamide
CID 27509093
[(6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino]thiourea
CID 3600555
N-[4-[[2-(azepan-1-yl)acetyl]amino]phenyl]propanamide
CID 54814408
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]propanamide
CID 896768
N-[4-(7-phenyl-2H-imidazo[2,1-b][1,3,4]thiadiazin-3-yl)phenyl]propanamide
CID 25469745
N-(4-pyrimidin-2-ylphenyl)propanamide
CID 137348877
N-[4-[[2-(propylamino)acetyl]amino]phenyl]propanamide
CID 54818859
N-[4-(2-ethylimino-3,6-dihydro-1,3,4-thiadiazin-5-yl)phenyl]propanamide
CID 135437918
2-(4-bromophenyl)-N-[4-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]acetamide
CID 18562205
N-[4-[3-(morpholine-4-carbonyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl]propanamide
CID 50839474
N-[4-(3-amino-7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
CID 82355817

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide?
The IUPAC name of N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide (CID 82367473) is N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide.
What is the SMILES notation for N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide?
The canonical SMILES for N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide is CCC(=O)Nc1ccc(-c2nc3n(c2C=O)CCS3)cc1.
What is the InChIKey of N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide?
The InChIKey is FIRZGSAGQBHVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-2-13(20)16-11-5-3-10(4-6-11)14-12(9-19)18-7-8-21-15(18)17-14/h3-6,9H,2,7-8H2,1H3,(H,16,20).
What are the key properties of N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide?
N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide has a molecular weight of 301.37 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-formyl-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide is sourced from PubChem (CID 82367473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).