1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea

C16H19N3O2 — CID 48739052

IUPAC1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea
SMILESCCn1cc(NC(=O)N(C)Cc2ccccc2)ccc1=O
InChIInChI=1S/C16H19N3O2/c1-3-19-12-14(9-10-15(19)20)17-16(21)18(2)11-13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3,(H,17,21)
InChIKeyJUYVVDZDFDJRTL-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.53
Rot. Bonds4

About 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea

1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea (PubChem CID 48739052) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea.

Molecular Properties

Compound Name1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea
PubChem CID48739052
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea
SMILESCCn1cc(NC(=O)N(C)Cc2ccccc2)ccc1=O
InChIInChI=1S/C16H19N3O2/c1-3-19-12-14(9-10-15(19)20)17-16(21)18(2)11-13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3,(H,17,21)
InChIKeyJUYVVDZDFDJRTL-UHFFFAOYSA-N
XLogP2.53
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea 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

benzyl N-(1-ethyl-6-oxo-3-pyridinyl)carbamate
CID 130157687
(2R)-2-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-phenylpropanamide
CID 78984653
1-(2-cyclopropyl-2-hydroxyethyl)-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea
CID 111859174
N-(1-ethyl-6-oxo-3-pyridinyl)-2-(2-phenylethyl)benzamide
CID 60557012
1-benzyl-1-methyl-3-pyridin-4-ylurea
CID 47385426
N-(1-benzyl-6-oxo-3-pyridinyl)acetamide
CID 167759496
N-(1-ethyl-6-oxo-3-pyridinyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 146323423
1-methyl-3-phenyl-1-[(4-phenylphenyl)methyl]urea
CID 134799082
2-bromo-N-(1-ethyl-6-oxo-3-pyridinyl)acetamide
CID 63680648
1-butyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-(2-hydroxyethyl)urea
CID 47434526
3-amino-1-benzyl-1-methylurea
CID 43163959
1-(1,3-benzodioxol-5-ylmethyl)-1-methyl-3-(1-methyl-6-oxo-3-pyridinyl)urea
CID 71938105

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea?
The IUPAC name of 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea (CID 48739052) is 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea.
What is the SMILES notation for 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea?
The canonical SMILES for 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea is CCn1cc(NC(=O)N(C)Cc2ccccc2)ccc1=O.
What is the InChIKey of 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea?
The InChIKey is JUYVVDZDFDJRTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-3-19-12-14(9-10-15(19)20)17-16(21)18(2)11-13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3,(H,17,21).
What are the key properties of 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea?
1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea has a molecular weight of 285.35 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-(1-ethyl-6-oxo-3-pyridinyl)-1-methylurea is sourced from PubChem (CID 48739052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).