1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one

C14H16N4O — CID 10563032

IUPAC1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one
SMILESCc1[nH]cnc1CN1CCN(c2ccccc2)C1=O
InChIInChI=1S/C14H16N4O/c1-11-13(16-10-15-11)9-17-7-8-18(14(17)19)12-5-3-2-4-6-12/h2-6,10H,7-9H2,1H3,(H,15,16)
InChIKeyALMFCDILQXFZII-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.16
Rot. Bonds3

About 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one

1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one (PubChem CID 10563032) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one.

Molecular Properties

Compound Name1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one
PubChem CID10563032
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one
SMILESCc1[nH]cnc1CN1CCN(c2ccccc2)C1=O
InChIInChI=1S/C14H16N4O/c1-11-13(16-10-15-11)9-17-7-8-18(14(17)19)12-5-3-2-4-6-12/h2-6,10H,7-9H2,1H3,(H,15,16)
InChIKeyALMFCDILQXFZII-UHFFFAOYSA-N
XLogP2.16
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one?
The IUPAC name of 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one (CID 10563032) is 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one.
What is the SMILES notation for 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one?
The canonical SMILES for 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one is Cc1[nH]cnc1CN1CCN(c2ccccc2)C1=O.
What is the InChIKey of 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one?
The InChIKey is ALMFCDILQXFZII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-11-13(16-10-15-11)9-17-7-8-18(14(17)19)12-5-3-2-4-6-12/h2-6,10H,7-9H2,1H3,(H,15,16).
What are the key properties of 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one?
1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one has a molecular weight of 256.31 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methyl-1H-imidazol-4-yl)methyl]-3-phenylimidazolidin-2-one is sourced from PubChem (CID 10563032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).