N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide

C20H18N4O3 — CID 9294420

IUPACN-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide
SMILESCC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc3ccccc3[nH]2)C1=O
InChIInChI=1S/C20H18N4O3/c1-2-20(14-9-4-3-5-10-14)18(26)24(19(27)22-20)23-17(25)16-12-13-8-6-7-11-15(13)21-16/h3-12,21H,2H2,1H3,(H,22,27)(H,23,25)/t20-/m0/s1
InChIKeyOAOWMJDGZXMOSD-FQEVSTJZSA-N
MW362.39 g/mol
LogP2.67
Rot. Bonds4

About N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide

N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide (PubChem CID 9294420) has the molecular formula C20H18N4O3 and a molecular weight of 362.39 g/mol. Its IUPAC name is N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide
PubChem CID9294420
Molecular FormulaC20H18N4O3
Molecular Weight362.39 g/mol
Exact Mass362.14
IUPAC NameN-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide
SMILESCC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc3ccccc3[nH]2)C1=O
InChIInChI=1S/C20H18N4O3/c1-2-20(14-9-4-3-5-10-14)18(26)24(19(27)22-20)23-17(25)16-12-13-8-6-7-11-15(13)21-16/h3-12,21H,2H2,1H3,(H,22,27)(H,23,25)/t20-/m0/s1
InChIKeyOAOWMJDGZXMOSD-FQEVSTJZSA-N
XLogP2.67
TPSA94.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]thiophene-3-carboxamide
CID 9294715
N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-3-(trifluoromethyl)benzamide
CID 9293615
5-ethyl-N-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-4-methylthiophene-2-carboxamide
CID 9294395
N-[2-[(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)amino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 24549178
N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-methyl-1-phenylbenzimidazole-5-carboxamide
CID 41023589
3-cyclopentyl-N-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]propanamide
CID 9293678
N-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-thiophen-2-ylacetamide
CID 9293561
N-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]oxane-4-carboxamide
CID 52528557
4-ethoxy-N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-3-nitrobenzamide
CID 9294657
N-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 24642473
benzyl-ethyl-[2-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]amino]-2-oxoethyl]azanium
CID 8564244
[2-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]amino]-2-oxoethyl] 2-ethoxyacetate
CID 9289684

Frequently Asked Questions

What is the IUPAC name of N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide?
The IUPAC name of N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide (CID 9294420) is N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide is CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc3ccccc3[nH]2)C1=O.
What is the InChIKey of N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide?
The InChIKey is OAOWMJDGZXMOSD-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H18N4O3/c1-2-20(14-9-4-3-5-10-14)18(26)24(19(27)22-20)23-17(25)16-12-13-8-6-7-11-15(13)21-16/h3-12,21H,2H2,1H3,(H,22,27)(H,23,25)/t20-/m0/s1.
What are the key properties of N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide?
N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide has a molecular weight of 362.39 g/mol, XLogP of 2.67, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-1H-indole-2-carboxamide is sourced from PubChem (CID 9294420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).