N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide

C19H20FN7O — CID 9338225

IUPACN-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(c2nnnn2-c2ccccc2)CC1)Nc1cccc(F)c1
InChIInChI=1S/C19H20FN7O/c20-15-5-4-6-16(13-15)21-18(28)14-25-9-11-26(12-10-25)19-22-23-24-27(19)17-7-2-1-3-8-17/h1-8,13H,9-12,14H2,(H,21,28)
InChIKeyNJSJFTJQHHDWBE-UHFFFAOYSA-N
MW381.41 g/mol
LogP1.56
Rot. Bonds5

About N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide

N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide (PubChem CID 9338225) has the molecular formula C19H20FN7O and a molecular weight of 381.41 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
PubChem CID9338225
Molecular FormulaC19H20FN7O
Molecular Weight381.41 g/mol
Exact Mass381.17
IUPAC NameN-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(c2nnnn2-c2ccccc2)CC1)Nc1cccc(F)c1
InChIInChI=1S/C19H20FN7O/c20-15-5-4-6-16(13-15)21-18(28)14-25-9-11-26(12-10-25)19-22-23-24-27(19)17-7-2-1-3-8-17/h1-8,13H,9-12,14H2,(H,21,28)
InChIKeyNJSJFTJQHHDWBE-UHFFFAOYSA-N
XLogP1.56
TPSA79.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.41
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]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-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 55601224
N-(4-tert-butylphenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
CID 33451759
N-(4-methylsulfonylphenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
CID 55601214
2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 51119848
N-benzyl-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
CID 26041068
2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]ethanethioamide
CID 63337234
4-[2-(3-fluoroanilino)-2-oxoethyl]-N-phenylpiperazine-1-carboxamide
CID 17397265
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
CID 55628324
N-(3-fluorophenyl)-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]acetamide
CID 46572374
2-(4-benzyl-1,4-diazepan-1-yl)-N-(3-fluorophenyl)acetamide
CID 16618233
2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide
CID 122279645
N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
CID 55600931

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide (CID 9338225) is N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide is O=C(CN1CCN(c2nnnn2-c2ccccc2)CC1)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide?
The InChIKey is NJSJFTJQHHDWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN7O/c20-15-5-4-6-16(13-15)21-18(28)14-25-9-11-26(12-10-25)19-22-23-24-27(19)17-7-2-1-3-8-17/h1-8,13H,9-12,14H2,(H,21,28).
What are the key properties of N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide?
N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide has a molecular weight of 381.41 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide is sourced from PubChem (CID 9338225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).