1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one

C14H17N3O — CID 116981002

IUPAC1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one
SMILESCCN1CC(c2cn(C)c3ccccc23)NC1=O
InChIInChI=1S/C14H17N3O/c1-3-17-9-12(15-14(17)18)11-8-16(2)13-7-5-4-6-10(11)13/h4-8,12H,3,9H2,1-2H3,(H,15,18)
InChIKeyGVEYRCKPKBOHMT-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.26
Rot. Bonds2

About 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one

1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one (PubChem CID 116981002) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one
PubChem CID116981002
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one
SMILESCCN1CC(c2cn(C)c3ccccc23)NC1=O
InChIInChI=1S/C14H17N3O/c1-3-17-9-12(15-14(17)18)11-8-16(2)13-7-5-4-6-10(11)13/h4-8,12H,3,9H2,1-2H3,(H,15,18)
InChIKeyGVEYRCKPKBOHMT-UHFFFAOYSA-N
XLogP2.26
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one?
The IUPAC name of 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one (CID 116981002) is 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one.
What is the SMILES notation for 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one?
The canonical SMILES for 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one is CCN1CC(c2cn(C)c3ccccc23)NC1=O.
What is the InChIKey of 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one?
The InChIKey is GVEYRCKPKBOHMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-17-9-12(15-14(17)18)11-8-16(2)13-7-5-4-6-10(11)13/h4-8,12H,3,9H2,1-2H3,(H,15,18).
What are the key properties of 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one?
1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one has a molecular weight of 243.31 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(1-methylindol-3-yl)imidazolidin-2-one is sourced from PubChem (CID 116981002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).