(2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide

C21H24N6O2 — CID 7588720

IUPAC(2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide
SMILESCC(=O)Nc1ccc(NC(=O)[C@@H](C)n2nnc(-c3ccc(C(C)C)cc3)n2)cc1
InChIInChI=1S/C21H24N6O2/c1-13(2)16-5-7-17(8-6-16)20-24-26-27(25-20)14(3)21(29)23-19-11-9-18(10-12-19)22-15(4)28/h5-14H,1-4H3,(H,22,28)(H,23,29)/t14-/m1/s1
InChIKeyNGMSLPLOMWPVNE-CQSZACIVSA-N
MW392.46 g/mol
LogP3.62
Rot. Bonds6

About (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide

(2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide (PubChem CID 7588720) has the molecular formula C21H24N6O2 and a molecular weight of 392.46 g/mol. Its IUPAC name is (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide
PubChem CID7588720
Molecular FormulaC21H24N6O2
Molecular Weight392.46 g/mol
Exact Mass392.20
IUPAC Name(2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide
SMILESCC(=O)Nc1ccc(NC(=O)[C@@H](C)n2nnc(-c3ccc(C(C)C)cc3)n2)cc1
InChIInChI=1S/C21H24N6O2/c1-13(2)16-5-7-17(8-6-16)20-24-26-27(25-20)14(3)21(29)23-19-11-9-18(10-12-19)22-15(4)28/h5-14H,1-4H3,(H,22,28)(H,23,29)/t14-/m1/s1
InChIKeyNGMSLPLOMWPVNE-CQSZACIVSA-N
XLogP3.62
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide 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

(2R)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]-N-(2,3,4-trifluorophenyl)propanamide
CID 7489678
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-(3,4-difluorophenyl)propanamide
CID 46583110
2-[5-(4-bromophenyl)tetrazol-2-yl]-N-[4-(difluoromethoxy)phenyl]propanamide
CID 43024295
(2S)-N-(4-bromophenyl)-2-[5-(3-chlorophenyl)tetrazol-2-yl]propanamide
CID 9355609
(2S)-2-[5-(4-bromophenyl)tetrazol-2-yl]-N-(3-chlorophenyl)propanamide
CID 9355658
2-propan-2-yl-5-(4-propan-2-ylphenyl)tetrazole
CID 126669266
(2S)-N-methyl-N-phenyl-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide
CID 7588870
(2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-phenyltetrazol-2-yl)propanamide
CID 1149424
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-(2-methylsulfanylphenyl)propanamide
CID 42986987
N-(2-methylphenyl)-2-(5-phenyltetrazol-2-yl)propanamide
CID 84602572
(2R)-N-(1-tert-butylpyrazol-4-yl)-2-(5-phenyltetrazol-2-yl)propanamide
CID 96560248
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 46582904

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide?
The IUPAC name of (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide (CID 7588720) is (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide.
What is the SMILES notation for (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide?
The canonical SMILES for (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide is CC(=O)Nc1ccc(NC(=O)[C@@H](C)n2nnc(-c3ccc(C(C)C)cc3)n2)cc1.
What is the InChIKey of (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide?
The InChIKey is NGMSLPLOMWPVNE-CQSZACIVSA-N. The full InChI is InChI=1S/C21H24N6O2/c1-13(2)16-5-7-17(8-6-16)20-24-26-27(25-20)14(3)21(29)23-19-11-9-18(10-12-19)22-15(4)28/h5-14H,1-4H3,(H,22,28)(H,23,29)/t14-/m1/s1.
What are the key properties of (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide?
(2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide has a molecular weight of 392.46 g/mol, XLogP of 3.62, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-acetamidophenyl)-2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]propanamide is sourced from PubChem (CID 7588720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).