N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide

C19H19N5O2 — CID 7634196

IUPACN-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide
SMILESCC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1nnc(-c2ccccc2)n1
InChIInChI=1S/C19H19N5O2/c1-14(25)17(12-15-8-4-2-5-9-15)20-18(26)13-24-22-19(21-23-24)16-10-6-3-7-11-16/h2-11,17H,12-13H2,1H3,(H,20,26)/t17-/m1/s1
InChIKeyHHMOJIFQSOOZHM-QGZVFWFLSA-N
MW349.39 g/mol
LogP1.66
Rot. Bonds7

About N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide

N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide (PubChem CID 7634196) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide.

Molecular Properties

Compound NameN-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide
PubChem CID7634196
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC NameN-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide
SMILESCC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1nnc(-c2ccccc2)n1
InChIInChI=1S/C19H19N5O2/c1-14(25)17(12-15-8-4-2-5-9-15)20-18(26)13-24-22-19(21-23-24)16-10-6-3-7-11-16/h2-11,17H,12-13H2,1H3,(H,20,26)/t17-/m1/s1
InChIKeyHHMOJIFQSOOZHM-QGZVFWFLSA-N
XLogP1.66
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]butanoic acid
CID 119221158
N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 29466684
N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634209
N-(3-oxo-1-phenylbutan-2-yl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
CID 75479453
N-[(1R)-1-cyclopropylethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 8685045
2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 7490784
3-phenyl-N'-[2-(5-phenyltetrazol-2-yl)acetyl]propanehydrazide
CID 9468283
N-(3-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 856053
N-(2,6-diethylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 16508168
N-[(1R)-1-phenylethyl]-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]acetamide
CID 7589016
2-(5-phenyltetrazol-2-yl)acetic acid
CID 1086563
2-[5-(3-chlorophenyl)tetrazol-2-yl]-N-[(1R)-1-phenylethyl]acetamide
CID 7490847

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide?
The IUPAC name of N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide (CID 7634196) is N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide.
What is the SMILES notation for N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide?
The canonical SMILES for N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide is CC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1nnc(-c2ccccc2)n1.
What is the InChIKey of N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide?
The InChIKey is HHMOJIFQSOOZHM-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-14(25)17(12-15-8-4-2-5-9-15)20-18(26)13-24-22-19(21-23-24)16-10-6-3-7-11-16/h2-11,17H,12-13H2,1H3,(H,20,26)/t17-/m1/s1.
What are the key properties of N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide?
N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide has a molecular weight of 349.39 g/mol, XLogP of 1.66, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide is sourced from PubChem (CID 7634196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).