2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide

C16H17N5O3 — CID 97319859

IUPAC2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide
SMILESC[C@@](O)(CNC(=O)Cn1nnc(-c2ccco2)n1)c1ccccc1
InChIInChI=1S/C16H17N5O3/c1-16(23,12-6-3-2-4-7-12)11-17-14(22)10-21-19-15(18-20-21)13-8-5-9-24-13/h2-9,23H,10-11H2,1H3,(H,17,22)/t16-/m1/s1
InChIKeyZEWIJRBAOZDYQC-MRXNPFEDSA-N
MW327.34 g/mol
LogP0.96
Rot. Bonds6

About 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide

2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide (PubChem CID 97319859) has the molecular formula C16H17N5O3 and a molecular weight of 327.34 g/mol. Its IUPAC name is 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide.

Molecular Properties

Compound Name2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide
PubChem CID97319859
Molecular FormulaC16H17N5O3
Molecular Weight327.34 g/mol
Exact Mass327.13
IUPAC Name2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide
SMILESC[C@@](O)(CNC(=O)Cn1nnc(-c2ccco2)n1)c1ccccc1
InChIInChI=1S/C16H17N5O3/c1-16(23,12-6-3-2-4-7-12)11-17-14(22)10-21-19-15(18-20-21)13-8-5-9-24-13/h2-9,23H,10-11H2,1H3,(H,17,22)/t16-/m1/s1
InChIKeyZEWIJRBAOZDYQC-MRXNPFEDSA-N
XLogP0.96
TPSA106.07 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide 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

2-[5-(furan-2-yl)tetrazol-2-yl]-N-(2-hydroxy-2-methylpropyl)acetamide
CID 65110497
4-[[2-[5-(furan-2-yl)tetrazol-2-yl]acetyl]amino]-2-methylbutanoic acid
CID 80537343
2-[[[2-[5-(furan-2-yl)tetrazol-2-yl]acetyl]amino]methyl]butanoic acid
CID 65219644
N-[(2R)-2-hydroxy-2-thiophen-3-ylpropyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 96567083
2-[5-(furan-2-yl)tetrazol-2-yl]-N-(2-hydroxy-4-methylpentyl)acetamide
CID 103771124
2-[5-(furan-2-yl)tetrazol-2-yl]-N-pentan-3-ylacetamide
CID 39998075
2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(1-hydroxycyclobutyl)methyl]acetamide
CID 115643437
2-[5-(furan-2-yl)tetrazol-2-yl]-N-(4-methylphenyl)acetamide
CID 43845168
2-[5-(furan-2-yl)tetrazol-2-yl]-N-(3-hydroxy-4-methoxybutyl)acetamide
CID 103876911
2-[[2-[5-(furan-2-yl)tetrazol-2-yl]acetyl]amino]-3-methoxypropanoic acid
CID 81084981
N-(2-cyclopropyl-2-hydroxyethyl)-2-[5-(furan-2-yl)tetrazol-2-yl]acetamide
CID 63294953
3-[ethyl-[2-[5-(furan-2-yl)tetrazol-2-yl]acetyl]amino]propanoic acid
CID 61007120

Frequently Asked Questions

What is the IUPAC name of 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide?
The IUPAC name of 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide (CID 97319859) is 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide.
What is the SMILES notation for 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide?
The canonical SMILES for 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide is C[C@@](O)(CNC(=O)Cn1nnc(-c2ccco2)n1)c1ccccc1.
What is the InChIKey of 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide?
The InChIKey is ZEWIJRBAOZDYQC-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H17N5O3/c1-16(23,12-6-3-2-4-7-12)11-17-14(22)10-21-19-15(18-20-21)13-8-5-9-24-13/h2-9,23H,10-11H2,1H3,(H,17,22)/t16-/m1/s1.
What are the key properties of 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide?
2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide has a molecular weight of 327.34 g/mol, XLogP of 0.96, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(furan-2-yl)tetrazol-2-yl]-N-[(2S)-2-hydroxy-2-phenylpropyl]acetamide is sourced from PubChem (CID 97319859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).