5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one

C19H22FN3O2 — CID 68841692

IUPAC5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one
SMILESCOc1ccc(CCN2C(=O)NCC2(N)Cc2ccc(F)cc2)cc1
InChIInChI=1S/C19H22FN3O2/c1-25-17-8-4-14(5-9-17)10-11-23-18(24)22-13-19(23,21)12-15-2-6-16(20)7-3-15/h2-9H,10-13,21H2,1H3,(H,22,24)
InChIKeyDAXBOEGPBHATFA-UHFFFAOYSA-N
MW343.40 g/mol
LogP2.30
Rot. Bonds6

About 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one

5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one (PubChem CID 68841692) has the molecular formula C19H22FN3O2 and a molecular weight of 343.40 g/mol. Its IUPAC name is 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one
PubChem CID68841692
Molecular FormulaC19H22FN3O2
Molecular Weight343.40 g/mol
Exact Mass343.17
IUPAC Name5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one
SMILESCOc1ccc(CCN2C(=O)NCC2(N)Cc2ccc(F)cc2)cc1
InChIInChI=1S/C19H22FN3O2/c1-25-17-8-4-14(5-9-17)10-11-23-18(24)22-13-19(23,21)12-15-2-6-16(20)7-3-15/h2-9H,10-13,21H2,1H3,(H,22,24)
InChIKeyDAXBOEGPBHATFA-UHFFFAOYSA-N
XLogP2.30
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.40
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one?
The IUPAC name of 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one (CID 68841692) is 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one.
What is the SMILES notation for 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one?
The canonical SMILES for 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one is COc1ccc(CCN2C(=O)NCC2(N)Cc2ccc(F)cc2)cc1.
What is the InChIKey of 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one?
The InChIKey is DAXBOEGPBHATFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O2/c1-25-17-8-4-14(5-9-17)10-11-23-18(24)22-13-19(23,21)12-15-2-6-16(20)7-3-15/h2-9H,10-13,21H2,1H3,(H,22,24).
What are the key properties of 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one?
5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one has a molecular weight of 343.40 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-5-[(4-fluorophenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]imidazolidin-2-one is sourced from PubChem (CID 68841692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).