1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole

C24H23FN10 — CID 18177219

IUPAC1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole
SMILESCn1nnc(-c2ccc3c(c2)c(C2=CCN(CCc4nn[nH]n4)CC2)cn3-c2ccc(F)cc2)n1
InChIInChI=1S/C24H23FN10/c1-33-29-24(28-32-33)17-2-7-22-20(14-17)21(15-35(22)19-5-3-18(25)4-6-19)16-8-11-34(12-9-16)13-10-23-26-30-31-27-23/h2-8,14-15H,9-13H2,1H3,(H,26,27,30,31)
InChIKeySGENEEPLZAWENK-UHFFFAOYSA-N
MW470.52 g/mol
LogP2.81
Rot. Bonds6

About 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole

1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole (PubChem CID 18177219) has the molecular formula C24H23FN10 and a molecular weight of 470.52 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole.

Molecular Properties

Compound Name1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole
PubChem CID18177219
Molecular FormulaC24H23FN10
Molecular Weight470.52 g/mol
Exact Mass470.21
IUPAC Name1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole
SMILESCn1nnc(-c2ccc3c(c2)c(C2=CCN(CCc4nn[nH]n4)CC2)cn3-c2ccc(F)cc2)n1
InChIInChI=1S/C24H23FN10/c1-33-29-24(28-32-33)17-2-7-22-20(14-17)21(15-35(22)19-5-3-18(25)4-6-19)16-8-11-34(12-9-16)13-10-23-26-30-31-27-23/h2-8,14-15H,9-13H2,1H3,(H,26,27,30,31)
InChIKeySGENEEPLZAWENK-UHFFFAOYSA-N
XLogP2.81
TPSA106.23 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.52
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole 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

1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]-3,6-dihydro-2H-pyridin-1-yl]ethyl]imidazolidin-2-one
CID 11081194
1-(4-fluorophenyl)-5-(1-methyltetrazol-5-yl)-3-(1,2,3,6-tetrahydropyridin-4-yl)indole
CID 91579816
1-(4-fluorophenyl)-5-(2-methyltriazol-4-yl)-3-(1,2,3,6-tetrahydropyridin-4-yl)indole
CID 11036104
5-chloro-1-(4-fluorophenyl)-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indole
CID 15648963
1-[2-[4-[1-(4-fluorophenyl)-5-(2-methyl-3H-pyrazol-1-yl)indol-3-yl]-3,6-dihydro-2H-pyridin-1-yl]ethyl]imidazolidin-2-one
CID 18177244
1-[2-[4-[1-(4-fluorophenyl)-6,7-dihydro-5H-cyclopenta[f]indol-3-yl]-3,6-dihydro-2H-pyridin-1-yl]ethyl]imidazolidin-2-one
CID 57290100
methyl 4-[5-chloro-3-[1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indol-1-yl]benzoate
CID 101339440
3-[4-(4-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]propane-1-sulfonic acid
CID 11220282
5-(2-pyrrolidin-1-ylethyl)-2H-tetrazole
CID 107912909
5-fluoro-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]sulfonylindole
CID 24743560
9-[(4-fluorophenyl)methyl]-3-(2H-tetrazol-5-yl)carbazole
CID 57457088
1-[2-[4-[1-(4-fluorophenyl)-5-(1-(111C)methyltriazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one
CID 70682616

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole?
The IUPAC name of 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole (CID 18177219) is 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole.
What is the SMILES notation for 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole?
The canonical SMILES for 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole is Cn1nnc(-c2ccc3c(c2)c(C2=CCN(CCc4nn[nH]n4)CC2)cn3-c2ccc(F)cc2)n1.
What is the InChIKey of 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole?
The InChIKey is SGENEEPLZAWENK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN10/c1-33-29-24(28-32-33)17-2-7-22-20(14-17)21(15-35(22)19-5-3-18(25)4-6-19)16-8-11-34(12-9-16)13-10-23-26-30-31-27-23/h2-8,14-15H,9-13H2,1H3,(H,26,27,30,31).
What are the key properties of 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole?
1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole has a molecular weight of 470.52 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-5-(2-methyltetrazol-5-yl)-3-[1-[2-(2H-tetrazol-5-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]indole is sourced from PubChem (CID 18177219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).