4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one

C14H18N4O2S — CID 136844671

IUPAC4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
SMILESO=c1cc(CCC2CN(Cc3nccs3)CCO2)nc[nH]1
InChIInChI=1S/C14H18N4O2S/c19-13-7-11(16-10-17-13)1-2-12-8-18(4-5-20-12)9-14-15-3-6-21-14/h3,6-7,10,12H,1-2,4-5,8-9H2,(H,16,17,19)
InChIKeyZHDRTEWBPPFELR-UHFFFAOYSA-N
MW306.39 g/mol
LogP1.06
Rot. Bonds5

About 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one

4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one (PubChem CID 136844671) has the molecular formula C14H18N4O2S and a molecular weight of 306.39 g/mol. Its IUPAC name is 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
PubChem CID136844671
Molecular FormulaC14H18N4O2S
Molecular Weight306.39 g/mol
Exact Mass306.12
IUPAC Name4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
SMILESO=c1cc(CCC2CN(Cc3nccs3)CCO2)nc[nH]1
InChIInChI=1S/C14H18N4O2S/c19-13-7-11(16-10-17-13)1-2-12-8-18(4-5-20-12)9-14-15-3-6-21-14/h3,6-7,10,12H,1-2,4-5,8-9H2,(H,16,17,19)
InChIKeyZHDRTEWBPPFELR-UHFFFAOYSA-N
XLogP1.06
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-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

4-[2-[4-[(3-methylthiophen-2-yl)methyl]morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 136844744
4-[2-[(2R)-4-[(3-methylthiophen-2-yl)methyl]morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 137037874
4-[2-[4-(pyridin-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 136844694
4-[2-[(2S)-4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 137052897
(2R)-2-(2-pyrimidin-4-ylethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine
CID 124941077
(2S)-2-(2-pyrimidin-4-ylethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine
CID 124941078
4-[2-[(2R)-4-[(4-methyl-3-pyridinyl)methyl]morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 137149630
4-[2-[(2S)-4-[(5-methyl-1H-pyrazol-4-yl)methyl]morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 137140144
4-[2-[4-[(1-propylpyrazol-4-yl)methyl]morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 136844775
4-[2-[(2S)-4-[(1-propylpyrazol-4-yl)methyl]morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 137140068
4-[2-[(2S)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 137131701
4-[2-[(2S)-4-pyrazin-2-ylmorpholin-2-yl]ethyl]-1H-pyrimidin-6-one
CID 137145707

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one?
The IUPAC name of 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one (CID 136844671) is 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one?
The canonical SMILES for 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one is O=c1cc(CCC2CN(Cc3nccs3)CCO2)nc[nH]1.
What is the InChIKey of 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one?
The InChIKey is ZHDRTEWBPPFELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2S/c19-13-7-11(16-10-17-13)1-2-12-8-18(4-5-20-12)9-14-15-3-6-21-14/h3,6-7,10,12H,1-2,4-5,8-9H2,(H,16,17,19).
What are the key properties of 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one?
4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one has a molecular weight of 306.39 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]-1H-pyrimidin-6-one is sourced from PubChem (CID 136844671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).