2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one

C18H18N6O2S — CID 58449101

IUPAC2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one
SMILESCN1C(=O)CC(C)(c2cc(CC(=O)c3cn4ccsc4n3)ccn2)N=C1N
InChIInChI=1S/C18H18N6O2S/c1-18(9-15(26)23(2)16(19)22-18)14-8-11(3-4-20-14)7-13(25)12-10-24-5-6-27-17(24)21-12/h3-6,8,10H,7,9H2,1-2H3,(H2,19,22)
InChIKeyXPLARMAMXBVXGK-UHFFFAOYSA-N
MW382.45 g/mol
LogP1.61
Rot. Bonds4

About 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one

2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one (PubChem CID 58449101) has the molecular formula C18H18N6O2S and a molecular weight of 382.45 g/mol. Its IUPAC name is 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one.

Molecular Properties

Compound Name2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one
PubChem CID58449101
Molecular FormulaC18H18N6O2S
Molecular Weight382.45 g/mol
Exact Mass382.12
IUPAC Name2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one
SMILESCN1C(=O)CC(C)(c2cc(CC(=O)c3cn4ccsc4n3)ccn2)N=C1N
InChIInChI=1S/C18H18N6O2S/c1-18(9-15(26)23(2)16(19)22-18)14-8-11(3-4-20-14)7-13(25)12-10-24-5-6-27-17(24)21-12/h3-6,8,10H,7,9H2,1-2H3,(H2,19,22)
InChIKeyXPLARMAMXBVXGK-UHFFFAOYSA-N
XLogP1.61
TPSA105.95 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.45
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-3,6-dimethyl-6-[4-[2-(5-methyl-1,2-thiazol-3-yl)-2-oxoethyl]-2-pyridinyl]-5H-pyrimidin-4-one
CID 58449273
2-amino-3,6-dimethyl-6-[4-[2-oxo-2-[5-[(E)-pent-1-enyl]pyrazin-2-yl]ethyl]-2-pyridinyl]-5H-pyrimidin-4-one
CID 58448898
2-amino-6-[3-[2-(2-isocyanoimidazo[1,2-a]pyrazin-6-yl)-2-oxoethyl]phenyl]-3,6-dimethyl-5H-pyrimidin-4-one
CID 58448560
2-amino-6-[5-[2-(2-chloro-1,3-oxazol-4-yl)-2-oxoethyl]-2-fluorophenyl]-3,6-dimethyl-5H-pyrimidin-4-one
CID 58448709
2-amino-6-[2-fluoro-5-[2-oxo-2-[5-(triazol-1-yl)pyrazin-2-yl]ethyl]phenyl]-3,6-dimethyl-5H-pyrimidin-4-one
CID 58449195
(6S)-2-amino-6-[4-(3-aminophenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one
CID 89248111
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide
CID 70234985
2-amino-3,6-dimethyl-6-[3-(2-oxo-2-thieno[3,2-b]thiophen-5-ylethyl)phenyl]-5H-pyrimidin-4-one
CID 58449125
2-amino-3,6-dimethyl-6-[3-(2-oxo-2-pyrazolo[1,5-a]pyridin-2-ylethyl)phenyl]-5H-pyrimidin-4-one
CID 58449146
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 70232328
2-amino-6-[3-[2-(3,5-dimethyl-2-pyridinyl)-2-oxoethyl]phenyl]-3,6-dimethyl-5H-pyrimidin-4-one
CID 58449206
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-4,5-dichloro-1,2-thiazole-3-carboxamide
CID 70235107

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one?
The IUPAC name of 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one (CID 58449101) is 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one.
What is the SMILES notation for 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one?
The canonical SMILES for 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one is CN1C(=O)CC(C)(c2cc(CC(=O)c3cn4ccsc4n3)ccn2)N=C1N.
What is the InChIKey of 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one?
The InChIKey is XPLARMAMXBVXGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O2S/c1-18(9-15(26)23(2)16(19)22-18)14-8-11(3-4-20-14)7-13(25)12-10-24-5-6-27-17(24)21-12/h3-6,8,10H,7,9H2,1-2H3,(H2,19,22).
What are the key properties of 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one?
2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one has a molecular weight of 382.45 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-[4-(2-imidazo[2,1-b][1,3]thiazol-6-yl-2-oxoethyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one is sourced from PubChem (CID 58449101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).