2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine

C14H16N2O — CID 84736004

IUPAC2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
SMILESCOc1ccccc1-c1cc2c([nH]1)CNCC2
InChIInChI=1S/C14H16N2O/c1-17-14-5-3-2-4-11(14)12-8-10-6-7-15-9-13(10)16-12/h2-5,8,15-16H,6-7,9H2,1H3
InChIKeyHGXNMPYWNCKPPH-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.34
Rot. Bonds2

About 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine

2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine (PubChem CID 84736004) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
PubChem CID84736004
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
SMILESCOc1ccccc1-c1cc2c([nH]1)CNCC2
InChIInChI=1S/C14H16N2O/c1-17-14-5-3-2-4-11(14)12-8-10-6-7-15-9-13(10)16-12/h2-5,8,15-16H,6-7,9H2,1H3
InChIKeyHGXNMPYWNCKPPH-UHFFFAOYSA-N
XLogP2.34
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-methoxyphenyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 79023920
2-naphthalen-1-yl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine
CID 28815394
5-(2-methoxyphenyl)-1H-pyrrole-2-carboxylic acid
CID 22507236
4-(2-methoxyphenyl)-1,2,3,6-tetrahydropyridine;hydrochloride
CID 71742594
1,3-bis[5-(2-methoxyphenyl)-1H-pyrrol-2-yl]propane-1,3-dione
CID 102394420
6-methoxy-8-phenyl-1,2,3,4-tetrahydroisoquinolin-7-ol
CID 153406501
2-(5-fluoro-2-methoxyphenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;dihydrochloride
CID 154901265
7-bromo-6-methoxy-1,2,3,4-tetrahydroisoquinoline
CID 82279765
6-(2-methoxyphenyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
CID 82391201
4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one
CID 6618949
8-fluoro-7-methoxy-1,2,3,4-tetrahydroisoquinoline
CID 84657900
5-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroisoquinoline
CID 106781910

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine (CID 84736004) is 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine is COc1ccccc1-c1cc2c([nH]1)CNCC2.
What is the InChIKey of 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is HGXNMPYWNCKPPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-17-14-5-3-2-4-11(14)12-8-10-6-7-15-9-13(10)16-12/h2-5,8,15-16H,6-7,9H2,1H3.
What are the key properties of 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine?
2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 228.30 g/mol, XLogP of 2.34, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 84736004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).