N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide

C14H15N3O2 — CID 110857948

IUPACN-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide
SMILESCCN(C(=O)c1cnc(C)[nH]c1=O)c1ccccc1
InChIInChI=1S/C14H15N3O2/c1-3-17(11-7-5-4-6-8-11)14(19)12-9-15-10(2)16-13(12)18/h4-9H,3H2,1-2H3,(H,15,16,18)
InChIKeyPKAPKKKISIDGME-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.75
Rot. Bonds3

About N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide

N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide (PubChem CID 110857948) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide
PubChem CID110857948
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide
SMILESCCN(C(=O)c1cnc(C)[nH]c1=O)c1ccccc1
InChIInChI=1S/C14H15N3O2/c1-3-17(11-7-5-4-6-8-11)14(19)12-9-15-10(2)16-13(12)18/h4-9H,3H2,1-2H3,(H,15,16,18)
InChIKeyPKAPKKKISIDGME-UHFFFAOYSA-N
XLogP1.75
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-methyl-N-phenylpyrimidine-5-carboxamide
CID 110857874
N-ethyl-4-(ethylamino)-6-methyl-N-phenylpyridine-3-carboxamide
CID 81238221
N-ethyl-2-methyl-N-phenylpyrimidine-5-carboxamide
CID 110857873
N-ethyl-3,5-dimethyl-N-phenylbenzamide
CID 134028664
2-methyl-N-(2-methylpropyl)-6-oxo-N-(3-phenylprop-2-ynyl)-1H-pyrimidine-5-carboxamide
CID 50953976
N-ethyl-5-methyl-N-phenyl-2H-triazole-4-carboxamide
CID 110691733
N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 46481510
N-ethyl-2,3-dihydroxy-N-phenylbenzamide
CID 114343845
N-ethyl-6-oxo-N-phenyl-1H-pyridine-3-carboxamide
CID 28830720
3-N,4-N-diethyl-1-methyl-3-N,4-N-diphenylpyrazole-3,4-dicarboxamide
CID 29097744
3-amino-2-[ethyl(phenyl)carbamoyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carboxylic acid
CID 90866364
N-ethyl-3,5-dimethyl-N-phenyl-1H-pyrazole-4-carboxamide
CID 43582677

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide?
The IUPAC name of N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide (CID 110857948) is N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide?
The canonical SMILES for N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide is CCN(C(=O)c1cnc(C)[nH]c1=O)c1ccccc1.
What is the InChIKey of N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide?
The InChIKey is PKAPKKKISIDGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-3-17(11-7-5-4-6-8-11)14(19)12-9-15-10(2)16-13(12)18/h4-9H,3H2,1-2H3,(H,15,16,18).
What are the key properties of N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide?
N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 110857948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).