N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide

C14H18FN3O3 — CID 71810654

IUPACN-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide
SMILESCOC(C)(CNC(=O)N1CCNC1=O)c1ccccc1F
InChIInChI=1S/C14H18FN3O3/c1-14(21-2,10-5-3-4-6-11(10)15)9-17-13(20)18-8-7-16-12(18)19/h3-6H,7-9H2,1-2H3,(H,16,19)(H,17,20)
InChIKeySYJWECBSPDSQGB-UHFFFAOYSA-N
MW295.31 g/mol
LogP1.42
Rot. Bonds4

About N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide

N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide (PubChem CID 71810654) has the molecular formula C14H18FN3O3 and a molecular weight of 295.31 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide
PubChem CID71810654
Molecular FormulaC14H18FN3O3
Molecular Weight295.31 g/mol
Exact Mass295.13
IUPAC NameN-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide
SMILESCOC(C)(CNC(=O)N1CCNC1=O)c1ccccc1F
InChIInChI=1S/C14H18FN3O3/c1-14(21-2,10-5-3-4-6-11(10)15)9-17-13(20)18-8-7-16-12(18)19/h3-6H,7-9H2,1-2H3,(H,16,19)(H,17,20)
InChIKeySYJWECBSPDSQGB-UHFFFAOYSA-N
XLogP1.42
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.31
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Profexalone
CID 65786
US10343992, Example 188
CID 122590681
N-Methyl-2-oxo-5-phenyl-1,3-oxazolidine-3-carboximidic acid
CID 214978
N-Ethyl-2-oxo-5-phenyl-1,3-oxazolidine-3-carboximidic acid
CID 214979
2-Oxo-5-phenyl-N-(propan-2-yl)-1,3-oxazolidine-3-carboximidic acid
CID 214980
3-Oxazolidinecarboxamide, 2-oxo-5-phenyl-N-2-propenyl-
CID 214981
N-Butyl-2-oxo-5-phenyl-1,3-oxazolidine-3-carboximidic acid
CID 214982
2-Oxo-5,5-diphenyl-N-(prop-2-en-1-yl)-1,3-oxazolidine-3-carboximidic acid
CID 214983
3-Oxazolidinecarboxamide, N-ethyl-5-(4-fluorophenyl)-2-oxo-
CID 214988
5-(4-Fluorophenyl)-2-oxo-N-propyl-1,3-oxazolidine-3-carboximidic acid
CID 214989
3-Oxazolidinecarboxamide, N-ethyl-5-(3-fluorophenyl)-2-oxo-
CID 214990
3-Oxazolidinecarboxamide, 5-(3-fluorophenyl)-2-oxo-N-propyl-
CID 214991

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide (CID 71810654) is N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide is COC(C)(CNC(=O)N1CCNC1=O)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide?
The InChIKey is SYJWECBSPDSQGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3O3/c1-14(21-2,10-5-3-4-6-11(10)15)9-17-13(20)18-8-7-16-12(18)19/h3-6H,7-9H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide?
N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide has a molecular weight of 295.31 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-methoxypropyl]-2-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 71810654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).