5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione

C15H18N4O2 — CID 10469232

IUPAC5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione
SMILESCN1C(=O)NC(Cc2ccc3[nH]cc(CCN)c3c2)C1=O
InChIInChI=1S/C15H18N4O2/c1-19-14(20)13(18-15(19)21)7-9-2-3-12-11(6-9)10(4-5-16)8-17-12/h2-3,6,8,13,17H,4-5,7,16H2,1H3,(H,18,21)
InChIKeyDGXUVTNZWRCEAJ-UHFFFAOYSA-N
MW286.34 g/mol
LogP0.76
Rot. Bonds4

About 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione

5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione (PubChem CID 10469232) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione
PubChem CID10469232
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione
SMILESCN1C(=O)NC(Cc2ccc3[nH]cc(CCN)c3c2)C1=O
InChIInChI=1S/C15H18N4O2/c1-19-14(20)13(18-15(19)21)7-9-2-3-12-11(6-9)10(4-5-16)8-17-12/h2-3,6,8,13,17H,4-5,7,16H2,1H3,(H,18,21)
InChIKeyDGXUVTNZWRCEAJ-UHFFFAOYSA-N
XLogP0.76
TPSA91.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[[1-[2-[3-(2-aminoethyl)-1H-indol-5-yl]ethyl]-2,5-dioxoimidazolidin-4-yl]methyl]phenyl]acetamide
CID 10094407
methyl 4-[[1-[2-[3-(2-aminoethyl)-1H-indol-5-yl]ethyl]-2,5-dioxoimidazolidin-4-yl]methyl]benzoate
CID 10478047
(5R)-5-[(5,6-dibromo-1H-indol-3-yl)methyl]-3-methylimidazolidine-2,4-dione
CID 162890732
4-[[4-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide;but-2-enedioic acid
CID 70382763
4-[2-[3-(2-aminoethyl)-1H-indol-5-yl]ethyl]-5-methylimidazolidin-2-one
CID 56989453
5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-1-benzylimidazolidine-2,4-dione
CID 67855202
2-[5-(2-phenylethyl)-1H-indol-3-yl]ethanamine
CID 22419950
5-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methyl]-3-[(4-phenoxyphenyl)methyl]imidazolidine-2,4-dione
CID 10412986
N-[3-[[1-[2-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]ethyl]-2,5-dioxoimidazolidin-4-yl]methyl]phenyl]acetamide
CID 10322070
1-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-benzylimidazolidin-2-one
CID 19752560
(5R)-3-methyl-5-[(7-methyl-1H-indol-3-yl)methyl]imidazolidine-2,4-dione
CID 71110493
1-[3-(2-aminoethyl)-1H-indol-5-yl]-N-(2-phenylethyl)methanesulfonamide;hydrochloride
CID 13286067

Frequently Asked Questions

What is the IUPAC name of 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione?
The IUPAC name of 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione (CID 10469232) is 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione.
What is the SMILES notation for 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione?
The canonical SMILES for 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione is CN1C(=O)NC(Cc2ccc3[nH]cc(CCN)c3c2)C1=O.
What is the InChIKey of 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione?
The InChIKey is DGXUVTNZWRCEAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-19-14(20)13(18-15(19)21)7-9-2-3-12-11(6-9)10(4-5-16)8-17-12/h2-3,6,8,13,17H,4-5,7,16H2,1H3,(H,18,21).
What are the key properties of 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione?
5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione has a molecular weight of 286.34 g/mol, XLogP of 0.76, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[3-(2-aminoethyl)-1H-indol-5-yl]methyl]-3-methylimidazolidine-2,4-dione is sourced from PubChem (CID 10469232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).