N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide

C15H16N6O2S — CID 70743209

IUPACN-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESO=C(NCc1cc(N2CCOCC2)ncn1)c1cn2ccsc2n1
InChIInChI=1S/C15H16N6O2S/c22-14(12-9-21-3-6-24-15(21)19-12)16-8-11-7-13(18-10-17-11)20-1-4-23-5-2-20/h3,6-7,9-10H,1-2,4-5,8H2,(H,16,22)
InChIKeyBQBPSGOEZFHPKJ-UHFFFAOYSA-N
MW344.40 g/mol
LogP0.95
Rot. Bonds4

About N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide

N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide (PubChem CID 70743209) has the molecular formula C15H16N6O2S and a molecular weight of 344.40 g/mol. Its IUPAC name is N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide.

Molecular Properties

Compound NameN-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
PubChem CID70743209
Molecular FormulaC15H16N6O2S
Molecular Weight344.40 g/mol
Exact Mass344.11
IUPAC NameN-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESO=C(NCc1cc(N2CCOCC2)ncn1)c1cn2ccsc2n1
InChIInChI=1S/C15H16N6O2S/c22-14(12-9-21-3-6-24-15(21)19-12)16-8-11-7-13(18-10-17-11)20-1-4-23-5-2-20/h3,6-7,9-10H,1-2,4-5,8H2,(H,16,22)
InChIKeyBQBPSGOEZFHPKJ-UHFFFAOYSA-N
XLogP0.95
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.40
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide
CID 18139618
N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 70714984
2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide
CID 70712162
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-morpholin-4-ylsulfonylbenzamide
CID 3887000
(5S)-3-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 95894343
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 70768062
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 17439083
N-[(2-fluorophenyl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 110851231
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-morpholin-4-ylsulfonylbenzamide
CID 55531398
N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 70755481
4-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)morpholine;hydrobromide
CID 6602914
2-(2-aminoethyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]-1,3-thiazole-4-carboxamide
CID 120641687

Frequently Asked Questions

What is the IUPAC name of N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?
The IUPAC name of N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide (CID 70743209) is N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide.
What is the SMILES notation for N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?
The canonical SMILES for N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide is O=C(NCc1cc(N2CCOCC2)ncn1)c1cn2ccsc2n1.
What is the InChIKey of N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?
The InChIKey is BQBPSGOEZFHPKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O2S/c22-14(12-9-21-3-6-24-15(21)19-12)16-8-11-7-13(18-10-17-11)20-1-4-23-5-2-20/h3,6-7,9-10H,1-2,4-5,8H2,(H,16,22).
What are the key properties of N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide?
N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide has a molecular weight of 344.40 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide is sourced from PubChem (CID 70743209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).