2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide

C19H17N7O3 — CID 9324140

IUPAC2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide
SMILESC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2cccc(-c3nn[nH]n3)c2)C1=O
InChIInChI=1S/C19H17N7O3/c1-19(13-7-3-2-4-8-13)17(28)26(18(29)21-19)11-15(27)20-14-9-5-6-12(10-14)16-22-24-25-23-16/h2-10H,11H2,1H3,(H,20,27)(H,21,29)(H,22,23,24,25)/t19-/m0/s1
InChIKeyNYUZDTGHKGLQOC-IBGZPJMESA-N
MW391.39 g/mol
LogP1.27
Rot. Bonds5

About 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide

2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide (PubChem CID 9324140) has the molecular formula C19H17N7O3 and a molecular weight of 391.39 g/mol. Its IUPAC name is 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide
PubChem CID9324140
Molecular FormulaC19H17N7O3
Molecular Weight391.39 g/mol
Exact Mass391.14
IUPAC Name2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide
SMILESC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2cccc(-c3nn[nH]n3)c2)C1=O
InChIInChI=1S/C19H17N7O3/c1-19(13-7-3-2-4-8-13)17(28)26(18(29)21-19)11-15(27)20-14-9-5-6-12(10-14)16-22-24-25-23-16/h2-10H,11H2,1H3,(H,20,27)(H,21,29)(H,22,23,24,25)/t19-/m0/s1
InChIKeyNYUZDTGHKGLQOC-IBGZPJMESA-N
XLogP1.27
TPSA132.97 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.39
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(3-methylsulfanylphenyl)acetamide
CID 2701920
2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-naphthalen-2-ylacetamide
CID 2580694
N-(4-bromophenyl)-2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2580352
N-(3-chloro-4-methylphenyl)-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2710976
2-[(4R)-4-(3,4-dimethoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-phenylphenyl)acetamide
CID 2612679
2-[4-(3,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide
CID 46638763
N-[3-(carbamoylamino)phenyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 55539585
N-(3-acetylphenyl)-2-[(4S)-4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]acetamide
CID 7595727
2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]-N-phenylacetamide
CID 17467243
5-[[2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]benzene-1,3-dicarboxamide
CID 2570395
2-[(4R)-4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-(3-methylphenyl)acetamide
CID 7595754
N-(2,3-dimethylphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 17438209

Frequently Asked Questions

What is the IUPAC name of 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide?
The IUPAC name of 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide (CID 9324140) is 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide.
What is the SMILES notation for 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide?
The canonical SMILES for 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide is C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2cccc(-c3nn[nH]n3)c2)C1=O.
What is the InChIKey of 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide?
The InChIKey is NYUZDTGHKGLQOC-IBGZPJMESA-N. The full InChI is InChI=1S/C19H17N7O3/c1-19(13-7-3-2-4-8-13)17(28)26(18(29)21-19)11-15(27)20-14-9-5-6-12(10-14)16-22-24-25-23-16/h2-10H,11H2,1H3,(H,20,27)(H,21,29)(H,22,23,24,25)/t19-/m0/s1.
What are the key properties of 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide?
2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide has a molecular weight of 391.39 g/mol, XLogP of 1.27, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide is sourced from PubChem (CID 9324140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).