3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide

C16H18N4O3 — CID 70723639

IUPAC3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILESO=C(CCC1NC(=O)NC1=O)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C16H18N4O3/c21-14(6-5-13-15(22)20-16(23)19-13)17-8-7-10-9-18-12-4-2-1-3-11(10)12/h1-4,9,13,18H,5-8H2,(H,17,21)(H2,19,20,22,23)
InChIKeyGIYCPAVXJVWHRA-UHFFFAOYSA-N
MW314.34 g/mol
LogP0.81
Rot. Bonds6

About 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide

3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide (PubChem CID 70723639) has the molecular formula C16H18N4O3 and a molecular weight of 314.34 g/mol. Its IUPAC name is 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
PubChem CID70723639
Molecular FormulaC16H18N4O3
Molecular Weight314.34 g/mol
Exact Mass314.14
IUPAC Name3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILESO=C(CCC1NC(=O)NC1=O)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C16H18N4O3/c21-14(6-5-13-15(22)20-16(23)19-13)17-8-7-10-9-18-12-4-2-1-3-11(10)12/h1-4,9,13,18H,5-8H2,(H,17,21)(H2,19,20,22,23)
InChIKeyGIYCPAVXJVWHRA-UHFFFAOYSA-N
XLogP0.81
TPSA103.09 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 50.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 75511825
3-chloro-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 588711
3-[(3S)-2,5-dioxo-3,4-dihydro-1H-1,4-benzodiazepin-3-yl]-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]propanamide
CID 71826995
6-amino-N-[2-(1H-indol-3-yl)ethyl]hexanamide
CID 61259839
4-[2-(1H-indol-3-yl)ethylamino]-4-oxobutanoate
CID 7019224
7-amino-N-[2-(1H-indol-3-yl)ethyl]heptanamide;hydrochloride
CID 75493600
3-[(4R)-1-[2-(1H-indol-3-yl)ethyl]-2,5-dioxoimidazolidin-4-yl]-N-(3-phenylpropyl)propanamide
CID 51842013
3-[1-[2-(1H-indol-3-yl)ethyl]-2,5-dioxoimidazolidin-4-yl]-N-(3-methylbutyl)propanamide
CID 73257190
3-[(4R)-1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 51833583
3-amino-N-[3-(1H-indol-3-yl)propyl]propanamide
CID 119320787
N-[2-(1H-indol-3-yl)ethyl]-3-(4-methylphenyl)propanamide
CID 16574540

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The IUPAC name of 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide (CID 70723639) is 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide.
What is the SMILES notation for 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The canonical SMILES for 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide is O=C(CCC1NC(=O)NC1=O)NCCc1c[nH]c2ccccc12.
What is the InChIKey of 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The InChIKey is GIYCPAVXJVWHRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3/c21-14(6-5-13-15(22)20-16(23)19-13)17-8-7-10-9-18-12-4-2-1-3-11(10)12/h1-4,9,13,18H,5-8H2,(H,17,21)(H2,19,20,22,23).
What are the key properties of 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide has a molecular weight of 314.34 g/mol, XLogP of 0.81, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dioxoimidazolidin-4-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide is sourced from PubChem (CID 70723639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).