N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide

C12H11N3O4 — CID 5080941

IUPACN-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C12H11N3O4/c1-19-8-5-3-2-4-7(8)11(17)13-9-6-10(16)15-12(18)14-9/h2-6H,1H3,(H3,13,14,15,16,17,18)
InChIKeyOYMRMWSJNRKGIK-UHFFFAOYSA-N
MW261.24 g/mol
LogP0.32
Rot. Bonds3

About N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide

N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide (PubChem CID 5080941) has the molecular formula C12H11N3O4 and a molecular weight of 261.24 g/mol. Its IUPAC name is N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide
PubChem CID5080941
Molecular FormulaC12H11N3O4
Molecular Weight261.24 g/mol
Exact Mass261.07
IUPAC NameN-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C12H11N3O4/c1-19-8-5-3-2-4-7(8)11(17)13-9-6-10(16)15-12(18)14-9/h2-6H,1H3,(H3,13,14,15,16,17,18)
InChIKeyOYMRMWSJNRKGIK-UHFFFAOYSA-N
XLogP0.32
TPSA104.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.24
LogP ≤ 50.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide
CID 4173907
N-(2,4-dioxo-1H-pyrimidin-6-yl)-4-methoxybenzamide
CID 3367770
2-methoxy-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]benzamide
CID 713343
2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 7741659
5-bromo-2-chloro-N-(2,4-dioxo-1H-pyrimidin-6-yl)benzamide
CID 2148524
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
N-(2-acetamidophenyl)-2-methoxybenzamide
CID 113093661
2-methoxy-N-[2-methoxy-4-[3-methoxy-4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 1119717
N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 814241
N-(5-chloro-2-fluorophenyl)-2-methoxybenzamide
CID 8759235
2-methoxybenzohydrazide
CID 24051
N-(2-methoxyphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 917217

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide?
The IUPAC name of N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide (CID 5080941) is N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide.
What is the SMILES notation for N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide?
The canonical SMILES for N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide is COc1ccccc1C(=O)Nc1cc(=O)[nH]c(=O)[nH]1.
What is the InChIKey of N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide?
The InChIKey is OYMRMWSJNRKGIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O4/c1-19-8-5-3-2-4-7(8)11(17)13-9-6-10(16)15-12(18)14-9/h2-6H,1H3,(H3,13,14,15,16,17,18).
What are the key properties of N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide?
N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide has a molecular weight of 261.24 g/mol, XLogP of 0.32, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dioxo-1H-pyrimidin-6-yl)-2-methoxybenzamide is sourced from PubChem (CID 5080941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).