6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione

C13H15N5O4 — CID 125005017

IUPAC6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione
SMILESCc1cnc([C@@H]2COCCN2C(=O)c2cc(=O)[nH]c(=O)[nH]2)[nH]1
InChIInChI=1S/C13H15N5O4/c1-7-5-14-11(15-7)9-6-22-3-2-18(9)12(20)8-4-10(19)17-13(21)16-8/h4-5,9H,2-3,6H2,1H3,(H,14,15)(H2,16,17,19,21)/t9-/m0/s1
InChIKeyTWKTYAMSZCINFI-VIFPVBQESA-N
MW305.29 g/mol
LogP-0.69
Rot. Bonds2

About 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione

6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione (PubChem CID 125005017) has the molecular formula C13H15N5O4 and a molecular weight of 305.29 g/mol. Its IUPAC name is 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione
PubChem CID125005017
Molecular FormulaC13H15N5O4
Molecular Weight305.29 g/mol
Exact Mass305.11
IUPAC Name6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione
SMILESCc1cnc([C@@H]2COCCN2C(=O)c2cc(=O)[nH]c(=O)[nH]2)[nH]1
InChIInChI=1S/C13H15N5O4/c1-7-5-14-11(15-7)9-6-22-3-2-18(9)12(20)8-4-10(19)17-13(21)16-8/h4-5,9H,2-3,6H2,1H3,(H,14,15)(H2,16,17,19,21)/t9-/m0/s1
InChIKeyTWKTYAMSZCINFI-VIFPVBQESA-N
XLogP-0.69
TPSA123.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.29
LogP ≤ 5-0.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione with MolForge

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Related Compounds

(3,5-difluorophenyl)-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 110105429
(5-fluoro-1H-indol-2-yl)-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 110105506
[(3S)-3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-pyrimidin-5-ylmethanone
CID 125017180
[(3S)-3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-(oxan-4-yl)methanone
CID 125016255
[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-(2-propan-2-ylpyrimidin-5-yl)methanone
CID 110105457
3-[(3S)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one
CID 124998854
(2,3-dimethyl-1H-indol-5-yl)-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 110105547
(3-cyclohexyl-1,2-oxazol-5-yl)-[(3S)-3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 125012998
(2-methyl-3H-benzimidazol-5-yl)-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 124959074
[(3S)-3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-quinolin-6-ylmethanone
CID 124996414
(1-ethyl-3-propan-2-ylpyrazol-5-yl)-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 124993027
(5-methylimidazo[1,2-a]pyridin-2-yl)-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methanone
CID 110105498

Frequently Asked Questions

What is the IUPAC name of 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione (CID 125005017) is 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione is Cc1cnc([C@@H]2COCCN2C(=O)c2cc(=O)[nH]c(=O)[nH]2)[nH]1.
What is the InChIKey of 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione?
The InChIKey is TWKTYAMSZCINFI-VIFPVBQESA-N. The full InChI is InChI=1S/C13H15N5O4/c1-7-5-14-11(15-7)9-6-22-3-2-18(9)12(20)8-4-10(19)17-13(21)16-8/h4-5,9H,2-3,6H2,1H3,(H,14,15)(H2,16,17,19,21)/t9-/m0/s1.
What are the key properties of 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione?
6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione has a molecular weight of 305.29 g/mol, XLogP of -0.69, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3R)-3-(5-methyl-1H-imidazol-2-yl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 125005017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).