N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide

C19H22N4O2S — CID 56902955

IUPACN-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESCOc1cccc(CN2CCCC(NC(=O)c3cn4ccsc4n3)C2)c1
InChIInChI=1S/C19H22N4O2S/c1-25-16-6-2-4-14(10-16)11-22-7-3-5-15(12-22)20-18(24)17-13-23-8-9-26-19(23)21-17/h2,4,6,8-10,13,15H,3,5,7,11-12H2,1H3,(H,20,24)
InChIKeyJHKKSEXLFAJAQW-UHFFFAOYSA-N
MW370.48 g/mol
LogP2.80
Rot. Bonds5

About N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide

N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide (PubChem CID 56902955) has the molecular formula C19H22N4O2S and a molecular weight of 370.48 g/mol. Its IUPAC name is N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide.

Molecular Properties

Compound NameN-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
PubChem CID56902955
Molecular FormulaC19H22N4O2S
Molecular Weight370.48 g/mol
Exact Mass370.15
IUPAC NameN-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESCOc1cccc(CN2CCCC(NC(=O)c3cn4ccsc4n3)C2)c1
InChIInChI=1S/C19H22N4O2S/c1-25-16-6-2-4-14(10-16)11-22-7-3-5-15(12-22)20-18(24)17-13-23-8-9-26-19(23)21-17/h2,4,6,8-10,13,15H,3,5,7,11-12H2,1H3,(H,20,24)
InChIKeyJHKKSEXLFAJAQW-UHFFFAOYSA-N
XLogP2.80
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.48
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide with MolForge

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Related Compounds

2-chloro-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]benzamide
CID 25449017
N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 25374475
N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-5-methyl-1-propylpyrazole-4-carboxamide
CID 45187769
methyl 2-[[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]amino]-6-methylpyrimidine-4-carboxylate
CID 70730726
N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-3-(2-oxoimidazolidin-1-yl)benzamide
CID 45210664
N-[(3R)-1-ethylsulfonylazepan-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 96578265
N-[(3S)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]-4-methoxypyridine-2-carboxamide
CID 126448618
1-cyclopentyl-3-[1-[[4-(3-methoxyphenyl)phenyl]methyl]piperidin-3-yl]urea
CID 134802563
2-(4-bromothiophen-2-yl)-N-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-1,3-thiazole-4-carboxamide
CID 55946613
N-[(3R)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]benzenesulfonamide
CID 95708462
azepan-1-yl-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]methanone
CID 3796866
1-[(3-methoxyphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 61029194

Frequently Asked Questions

What is the IUPAC name of N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?
The IUPAC name of N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide (CID 56902955) is N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide.
What is the SMILES notation for N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?
The canonical SMILES for N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide is COc1cccc(CN2CCCC(NC(=O)c3cn4ccsc4n3)C2)c1.
What is the InChIKey of N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?
The InChIKey is JHKKSEXLFAJAQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2S/c1-25-16-6-2-4-14(10-16)11-22-7-3-5-15(12-22)20-18(24)17-13-23-8-9-26-19(23)21-17/h2,4,6,8-10,13,15H,3,5,7,11-12H2,1H3,(H,20,24).
What are the key properties of N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?
N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide has a molecular weight of 370.48 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]imidazo[2,1-b][1,3]thiazole-6-carboxamide is sourced from PubChem (CID 56902955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).