2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine

C24H26N4 — CID 137353307

IUPAC2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCCc1cccc(CC)c1-n1nc2c(c1-c1ccc3[nH]ccc3c1)CNCC2
InChIInChI=1S/C24H26N4/c1-3-16-6-5-7-17(4-2)23(16)28-24(20-15-25-12-11-22(20)27-28)19-8-9-21-18(14-19)10-13-26-21/h5-10,13-14,25-26H,3-4,11-12,15H2,1-2H3
InChIKeyQNBWGHPLXSGJDN-UHFFFAOYSA-N
MW370.50 g/mol
LogP4.79
Rot. Bonds4

About 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine

2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine (PubChem CID 137353307) has the molecular formula C24H26N4 and a molecular weight of 370.50 g/mol. Its IUPAC name is 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
PubChem CID137353307
Molecular FormulaC24H26N4
Molecular Weight370.50 g/mol
Exact Mass370.22
IUPAC Name2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCCc1cccc(CC)c1-n1nc2c(c1-c1ccc3[nH]ccc3c1)CNCC2
InChIInChI=1S/C24H26N4/c1-3-16-6-5-7-17(4-2)23(16)28-24(20-15-25-12-11-22(20)27-28)19-8-9-21-18(14-19)10-13-26-21/h5-10,13-14,25-26H,3-4,11-12,15H2,1-2H3
InChIKeyQNBWGHPLXSGJDN-UHFFFAOYSA-N
XLogP4.79
TPSA45.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The IUPAC name of 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine (CID 137353307) is 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine.
What is the SMILES notation for 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The canonical SMILES for 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine is CCc1cccc(CC)c1-n1nc2c(c1-c1ccc3[nH]ccc3c1)CNCC2.
What is the InChIKey of 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The InChIKey is QNBWGHPLXSGJDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4/c1-3-16-6-5-7-17(4-2)23(16)28-24(20-15-25-12-11-22(20)27-28)19-8-9-21-18(14-19)10-13-26-21/h5-10,13-14,25-26H,3-4,11-12,15H2,1-2H3.
What are the key properties of 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine has a molecular weight of 370.50 g/mol, XLogP of 4.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-diethylphenyl)-3-(1H-indol-5-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine is sourced from PubChem (CID 137353307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).