furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride

C16H25ClN6O3 — CID 6603457

IUPACfuran-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride
SMILESCCC(c1nnnn1CCOC)N1CCN(C(=O)c2ccco2)CC1.Cl
InChIInChI=1S/C16H24N6O3.ClH/c1-3-13(15-17-18-19-22(15)10-12-24-2)20-6-8-21(9-7-20)16(23)14-5-4-11-25-14;/h4-5,11,13H,3,6-10,12H2,1-2H3;1H
InChIKeyHMJGRQBFWNTGGS-UHFFFAOYSA-N
MW384.87 g/mol
LogP1.24
Rot. Bonds7

About furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride

furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride (PubChem CID 6603457) has the molecular formula C16H25ClN6O3 and a molecular weight of 384.87 g/mol. Its IUPAC name is furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride.

Molecular Properties

Compound Namefuran-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride
PubChem CID6603457
Molecular FormulaC16H25ClN6O3
Molecular Weight384.87 g/mol
Exact Mass384.17
IUPAC Namefuran-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride
SMILESCCC(c1nnnn1CCOC)N1CCN(C(=O)c2ccco2)CC1.Cl
InChIInChI=1S/C16H24N6O3.ClH/c1-3-13(15-17-18-19-22(15)10-12-24-2)20-6-8-21(9-7-20)16(23)14-5-4-11-25-14;/h4-5,11,13H,3,6-10,12H2,1-2H3;1H
InChIKeyHMJGRQBFWNTGGS-UHFFFAOYSA-N
XLogP1.24
TPSA89.52 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.87
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride 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

{4-[1-(1-Cyclohexyl-1H-tetrazol-5-yl)-butyl]-piperazin-1-yl}-furan-2-yl-methanone
CID 24792460
1-[4-(2-Furylcarbonyl)piperazinyl]-2-(1-methyl(1,2,3,4-tetraazol-5-ylthio))eth an-1-one
CID 1081022
N-[2-(3,5-dimethyl-1,2,4-triazol-1-yl)propyl]furan-2-carboxamide
CID 6499832
Furan-2-carboxylic acid [2-(3,5-dimethyl-[1,2,4]triazol-1-yl)-ethyl]-amide
CID 6499844
1-Cyclopentyl-4-[1-(1-furan-2-ylmethyl-1H-tetrazol-5-yl)-butyl]-piperazine
CID 644666
Furan-2-yl-(4-{[1-(tetrahydro-furan-2-ylmethyl)-1H-tetrazol-5-yl]-p-tolyl-methyl}-piperazin-1-yl)-methanone
CID 648836
{4-[(1-Cyclohexyl-1H-tetrazol-5-yl)-thiophen-2-yl-methyl]-piperazin-1-yl}-furan-2-yl-methanone
CID 650097
Furan-2-yl-{4-[3-methyl-1-(1-phenethyl-1H-tetrazol-5-yl)-butyl]-piperazin-1-yl}-methanone
CID 650696
(4-{1-[1-(4-Fluoro-benzyl)-1H-tetrazol-5-yl]-2-methyl-propyl}-piperazin-1-yl)-furan-2-yl-methanone
CID 651772
(4-{(4-Chloro-phenyl)-[1-(tetrahydro-furan-2-ylmethyl)-1H-tetrazol-5-yl]-methyl}-piperazin-1-yl)-furan-2-yl-methanone
CID 655364
(4-{(4-Fluoro-phenyl)-[1-(3-methyl-butyl)-1H-tetrazol-5-yl]-methyl}-piperazin-1-yl)-furan-2-yl-methanone
CID 655575
2-(1-Cyclohexyltetrazol-5-yl)sulfanyl-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone
CID 1440841

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride?
The IUPAC name of furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride (CID 6603457) is furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride.
What is the SMILES notation for furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride?
The canonical SMILES for furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride is CCC(c1nnnn1CCOC)N1CCN(C(=O)c2ccco2)CC1.Cl.
What is the InChIKey of furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride?
The InChIKey is HMJGRQBFWNTGGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N6O3.ClH/c1-3-13(15-17-18-19-22(15)10-12-24-2)20-6-8-21(9-7-20)16(23)14-5-4-11-25-14;/h4-5,11,13H,3,6-10,12H2,1-2H3;1H.
What are the key properties of furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride?
furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride has a molecular weight of 384.87 g/mol, XLogP of 1.24, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-[1-[1-(2-methoxyethyl)tetrazol-5-yl]propyl]piperazin-1-yl]methanone;hydrochloride is sourced from PubChem (CID 6603457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).