N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide

C19H20N4O5 — CID 51115082

IUPACN-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
SMILESCc1[nH]c(=O)[nH]c(=O)c1CCC(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1
InChIInChI=1S/C19H20N4O5/c1-11-14(18(27)22-19(28)20-11)9-10-15(24)21-12-5-7-13(8-6-12)23-16(25)3-2-4-17(23)26/h5-8H,2-4,9-10H2,1H3,(H,21,24)(H2,20,22,27,28)
InChIKeyQMWAQTDQURRLGJ-UHFFFAOYSA-N
MW384.39 g/mol
LogP0.99
Rot. Bonds5

About N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide

N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide (PubChem CID 51115082) has the molecular formula C19H20N4O5 and a molecular weight of 384.39 g/mol. Its IUPAC name is N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide.

Molecular Properties

Compound NameN-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
PubChem CID51115082
Molecular FormulaC19H20N4O5
Molecular Weight384.39 g/mol
Exact Mass384.14
IUPAC NameN-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
SMILESCc1[nH]c(=O)[nH]c(=O)c1CCC(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1
InChIInChI=1S/C19H20N4O5/c1-11-14(18(27)22-19(28)20-11)9-10-15(24)21-12-5-7-13(8-6-12)23-16(25)3-2-4-17(23)26/h5-8H,2-4,9-10H2,1H3,(H,21,24)(H2,20,22,27,28)
InChIKeyQMWAQTDQURRLGJ-UHFFFAOYSA-N
XLogP0.99
TPSA132.20 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.39
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

4-acetyl-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-ethyl-5-methyl-1H-pyrrole-2-carboxamide
CID 60511680
(E)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-5-phenylpent-4-enamide
CID 75421720
3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[3-(2-pyridin-2-ylethynyl)phenyl]propanamide
CID 55549916
3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-(2-phenylethyl)propanamide
CID 30865434
N-(3-methylbutan-2-yl)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
CID 42930049
3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-(2,3-dihydro-1H-inden-5-yl)propanamide
CID 7530470
3-(benzimidazol-1-yl)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]propanamide
CID 60553645
N-[(E)-(4-chlorophenyl)methylideneamino]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
CID 110526446
N-(3,3-dimethylcyclopentyl)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
CID 115880598
3-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(4-ethylphenyl)propanamide
CID 135550253
methyl 3-[1-[4-[[4-(2,6-dioxopiperidin-1-yl)phenyl]carbamoyl]phenyl]-3,5-dimethylpyrazol-4-yl]propanoate
CID 55706159
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
CID 35340490

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide?
The IUPAC name of N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide (CID 51115082) is N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide.
What is the SMILES notation for N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide?
The canonical SMILES for N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide is Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1.
What is the InChIKey of N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide?
The InChIKey is QMWAQTDQURRLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O5/c1-11-14(18(27)22-19(28)20-11)9-10-15(24)21-12-5-7-13(8-6-12)23-16(25)3-2-4-17(23)26/h5-8H,2-4,9-10H2,1H3,(H,21,24)(H2,20,22,27,28).
What are the key properties of N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide?
N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide has a molecular weight of 384.39 g/mol, XLogP of 0.99, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide is sourced from PubChem (CID 51115082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).