1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea

C15H21N3O3 — CID 60562162

IUPAC1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea
SMILESCC(C)CNC(=O)NCc1cccc(N2CCOC2=O)c1
InChIInChI=1S/C15H21N3O3/c1-11(2)9-16-14(19)17-10-12-4-3-5-13(8-12)18-6-7-21-15(18)20/h3-5,8,11H,6-7,9-10H2,1-2H3,(H2,16,17,19)
InChIKeyKGYOJNBVYDNXQK-UHFFFAOYSA-N
MW291.35 g/mol
LogP2.10
Rot. Bonds5

About 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea

1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea (PubChem CID 60562162) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea.

Molecular Properties

Compound Name1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea
PubChem CID60562162
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea
SMILESCC(C)CNC(=O)NCc1cccc(N2CCOC2=O)c1
InChIInChI=1S/C15H21N3O3/c1-11(2)9-16-14(19)17-10-12-4-3-5-13(8-12)18-6-7-21-15(18)20/h3-5,8,11H,6-7,9-10H2,1-2H3,(H2,16,17,19)
InChIKeyKGYOJNBVYDNXQK-UHFFFAOYSA-N
XLogP2.10
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea 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

1-[(2-fluorophenyl)methyl]-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea
CID 71940501
1-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]-3-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)urea
CID 166185041
3-[3-(ethylaminomethyl)phenyl]-1,3-oxazinan-2-one
CID 61349238
3-(2-methoxyphenyl)-N-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]propanamide
CID 55932832
N-[3-methyl-1-oxo-1-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methylamino]pentan-2-yl]benzamide
CID 55814917
5-bromo-N-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]pyridine-3-carboxamide
CID 55814674
4-methyl-3-methylsulfonyl-N-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]benzamide
CID 94659890
1-[(3-methylphenyl)methyl]-3-(2-methylpropyl)urea
CID 47159778
N-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 55814453
N-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
CID 55814387
5-benzyl-1-methyl-N-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]pyrazole-4-carboxamide
CID 167833868
2-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]acetaldehyde
CID 57444342

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea?
The IUPAC name of 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea (CID 60562162) is 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea.
What is the SMILES notation for 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea?
The canonical SMILES for 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea is CC(C)CNC(=O)NCc1cccc(N2CCOC2=O)c1.
What is the InChIKey of 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea?
The InChIKey is KGYOJNBVYDNXQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-11(2)9-16-14(19)17-10-12-4-3-5-13(8-12)18-6-7-21-15(18)20/h3-5,8,11H,6-7,9-10H2,1-2H3,(H2,16,17,19).
What are the key properties of 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea?
1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea has a molecular weight of 291.35 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-3-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]urea is sourced from PubChem (CID 60562162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).