2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride

C17H19ClN2 — CID 67142157

IUPAC2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride
SMILESCc1[nH]c2c(CCc3ccccc3)nccc2c1C.Cl
InChIInChI=1S/C17H18N2.ClH/c1-12-13(2)19-17-15(12)10-11-18-16(17)9-8-14-6-4-3-5-7-14;/h3-7,10-11,19H,8-9H2,1-2H3;1H
InChIKeyUIMMBMKNMNWEOH-UHFFFAOYSA-N
MW286.81 g/mol
LogP4.39
Rot. Bonds3

About 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride

2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride (PubChem CID 67142157) has the molecular formula C17H19ClN2 and a molecular weight of 286.81 g/mol. Its IUPAC name is 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride.

Molecular Properties

Compound Name2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride
PubChem CID67142157
Molecular FormulaC17H19ClN2
Molecular Weight286.81 g/mol
Exact Mass286.12
IUPAC Name2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride
SMILESCc1[nH]c2c(CCc3ccccc3)nccc2c1C.Cl
InChIInChI=1S/C17H18N2.ClH/c1-12-13(2)19-17-15(12)10-11-18-16(17)9-8-14-6-4-3-5-7-14;/h3-7,10-11,19H,8-9H2,1-2H3;1H
InChIKeyUIMMBMKNMNWEOH-UHFFFAOYSA-N
XLogP4.39
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.81
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride?
The IUPAC name of 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride (CID 67142157) is 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride.
What is the SMILES notation for 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride?
The canonical SMILES for 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride is Cc1[nH]c2c(CCc3ccccc3)nccc2c1C.Cl.
What is the InChIKey of 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride?
The InChIKey is UIMMBMKNMNWEOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2.ClH/c1-12-13(2)19-17-15(12)10-11-18-16(17)9-8-14-6-4-3-5-7-14;/h3-7,10-11,19H,8-9H2,1-2H3;1H.
What are the key properties of 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride?
2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride has a molecular weight of 286.81 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-7-(2-phenylethyl)-1H-pyrrolo[2,3-c]pyridine;hydrochloride is sourced from PubChem (CID 67142157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).