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

C19H21N5O3S — CID 131942524

IUPACN-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NCC2CCCN(C(=O)c3cn4ccsc4n3)C2)cn1
InChIInChI=1S/C19H21N5O3S/c1-27-16-5-4-14(10-20-16)17(25)21-9-13-3-2-6-23(11-13)18(26)15-12-24-7-8-28-19(24)22-15/h4-5,7-8,10,12-13H,2-3,6,9,11H2,1H3,(H,21,25)
InChIKeyAWOJUKQSQWJUTC-UHFFFAOYSA-N
MW399.48 g/mol
LogP2.08
Rot. Bonds5

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

N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide (PubChem CID 131942524) has the molecular formula C19H21N5O3S and a molecular weight of 399.48 g/mol. Its IUPAC name is N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide
PubChem CID131942524
Molecular FormulaC19H21N5O3S
Molecular Weight399.48 g/mol
Exact Mass399.14
IUPAC NameN-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NCC2CCCN(C(=O)c3cn4ccsc4n3)C2)cn1
InChIInChI=1S/C19H21N5O3S/c1-27-16-5-4-14(10-20-16)17(25)21-9-13-3-2-6-23(11-13)18(26)15-12-24-7-8-28-19(24)22-15/h4-5,7-8,10,12-13H,2-3,6,9,11H2,1H3,(H,21,25)
InChIKeyAWOJUKQSQWJUTC-UHFFFAOYSA-N
XLogP2.08
TPSA88.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.48
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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

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Related Compounds

[(3S)-3-aminopiperidin-1-yl]-(6-methoxy-3-pyridinyl)methanone
CID 129493895
(6-methoxy-3-pyridinyl)-[3-[(4-methylpiperazin-1-yl)methyl]piperidin-1-yl]methanone
CID 90652589
1-[[(3R)-1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]triazole-4-carboxylic acid
CID 95211600
methyl 4-[3-[[(4-fluorobenzoyl)amino]methyl]piperidine-1-carbonyl]benzoate
CID 24817518
methyl 4-[(3R)-3-[[(4-fluorobenzoyl)amino]methyl]piperidine-1-carbonyl]benzoate
CID 42157752
6-methoxy-N-[[(3R)-1-(3-methoxypropyl)pyrrolidin-3-yl]methyl]pyridine-3-carboxamide
CID 125169256
4-fluoro-3-methoxy-N-[[1-(pyrazine-2-carbonyl)piperidin-3-yl]methyl]benzamide
CID 131912931
N-[[1-(3,4-dimethoxybenzoyl)piperidin-3-yl]methyl]-4-fluorobenzamide
CID 24790363
3,5-dimethoxy-N-[[(3R)-1-(1,3-thiazole-4-carbonyl)piperidin-3-yl]methyl]benzamide
CID 42216109
N-(4-fluoro-2-methylphenyl)-3-[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]propanamide
CID 45183724
[(3S)-3-(4-ethyl-1,3-thiazol-2-yl)piperidin-1-yl]-(6-methoxy-3-pyridinyl)methanone
CID 95768051
4-fluoro-N-[[(3R)-1-(6-methylpyridine-2-carbonyl)piperidin-3-yl]methyl]benzamide
CID 25481314

Frequently Asked Questions

What is the IUPAC name of N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide (CID 131942524) is N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide is COc1ccc(C(=O)NCC2CCCN(C(=O)c3cn4ccsc4n3)C2)cn1.
What is the InChIKey of N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide?
The InChIKey is AWOJUKQSQWJUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3S/c1-27-16-5-4-14(10-20-16)17(25)21-9-13-3-2-6-23(11-13)18(26)15-12-24-7-8-28-19(24)22-15/h4-5,7-8,10,12-13H,2-3,6,9,11H2,1H3,(H,21,25).
What are the key properties of N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide?
N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide has a molecular weight of 399.48 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(imidazo[2,1-b][1,3]thiazole-6-carbonyl)piperidin-3-yl]methyl]-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 131942524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).