N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide

C23H21N5O2 — CID 41048048

IUPACN-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide
SMILESC[C@H](NC(=O)COc1ccc(-n2cnnn2)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H21N5O2/c1-17(18-7-9-20(10-8-18)19-5-3-2-4-6-19)25-23(29)15-30-22-13-11-21(12-14-22)28-16-24-26-27-28/h2-14,16-17H,15H2,1H3,(H,25,29)/t17-/m0/s1
InChIKeyQUVUWIQRVQHORG-KRWDZBQOSA-N
MW399.45 g/mol
LogP3.59
Rot. Bonds7

About N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide

N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide (PubChem CID 41048048) has the molecular formula C23H21N5O2 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide
PubChem CID41048048
Molecular FormulaC23H21N5O2
Molecular Weight399.45 g/mol
Exact Mass399.17
IUPAC NameN-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide
SMILESC[C@H](NC(=O)COc1ccc(-n2cnnn2)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H21N5O2/c1-17(18-7-9-20(10-8-18)19-5-3-2-4-6-19)25-23(29)15-30-22-13-11-21(12-14-22)28-16-24-26-27-28/h2-14,16-17H,15H2,1H3,(H,25,29)/t17-/m0/s1
InChIKeyQUVUWIQRVQHORG-KRWDZBQOSA-N
XLogP3.59
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]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

N-(4-propan-2-ylphenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
CID 2709032
2-(4-phenoxyphenoxy)-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]acetamide
CID 134011978
N-prop-2-ynyl-2-[4-(tetrazol-1-yl)phenoxy]acetamide
CID 40769610
2-(4-phenoxyphenoxy)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55500018
2-(4-propan-2-ylphenoxy)-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]acetamide
CID 25471828
N-[(1S)-1-naphthalen-1-ylethyl]-2-[3-(tetrazol-1-yl)phenoxy]acetamide
CID 40769723
N-(1-pyrazin-2-ylpropan-2-yl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
CID 91782196
2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 836085
N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 47046813
N-[(2S)-3-oxo-1-phenylbutan-2-yl]-2-[3-(tetrazol-1-yl)phenoxy]acetamide
CID 7769152
2-(4-bromophenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 879347
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide
CID 39818945

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide?
The IUPAC name of N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide (CID 41048048) is N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide.
What is the SMILES notation for N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide?
The canonical SMILES for N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide is C[C@H](NC(=O)COc1ccc(-n2cnnn2)cc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide?
The InChIKey is QUVUWIQRVQHORG-KRWDZBQOSA-N. The full InChI is InChI=1S/C23H21N5O2/c1-17(18-7-9-20(10-8-18)19-5-3-2-4-6-19)25-23(29)15-30-22-13-11-21(12-14-22)28-16-24-26-27-28/h2-14,16-17H,15H2,1H3,(H,25,29)/t17-/m0/s1.
What are the key properties of N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide?
N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide has a molecular weight of 399.45 g/mol, XLogP of 3.59, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-phenylphenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide is sourced from PubChem (CID 41048048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).