7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine

C21H25N3 — CID 11515256

IUPAC7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine
SMILESCc1[nH]c2c(N3CCC(Cc4ccccc4)CC3)nccc2c1C
InChIInChI=1S/C21H25N3/c1-15-16(2)23-20-19(15)8-11-22-21(20)24-12-9-18(10-13-24)14-17-6-4-3-5-7-17/h3-8,11,18,23H,9-10,12-14H2,1-2H3
InChIKeyNWYFRIQJZBDYIT-UHFFFAOYSA-N
MW319.45 g/mol
LogP4.64
Rot. Bonds3

About 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine

7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine (PubChem CID 11515256) has the molecular formula C21H25N3 and a molecular weight of 319.45 g/mol. Its IUPAC name is 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine
PubChem CID11515256
Molecular FormulaC21H25N3
Molecular Weight319.45 g/mol
Exact Mass319.20
IUPAC Name7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine
SMILESCc1[nH]c2c(N3CCC(Cc4ccccc4)CC3)nccc2c1C
InChIInChI=1S/C21H25N3/c1-15-16(2)23-20-19(15)8-11-22-21(20)24-12-9-18(10-13-24)14-17-6-4-3-5-7-17/h3-8,11,18,23H,9-10,12-14H2,1-2H3
InChIKeyNWYFRIQJZBDYIT-UHFFFAOYSA-N
XLogP4.64
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine 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

7-(4-benzylpiperidin-1-yl)-1-(2-methoxyethyl)-2,3-dimethylpyrrolo[2,3-c]pyridine;hydrochloride
CID 142681075
2-(2,3-dimethyl-1H-pyrrolo[2,3-c]pyridin-7-yl)-3,4-dihydro-1H-isoquinoline;hydrochloride
CID 67141169
3-(4-benzylpiperidin-1-yl)-1H-pyrazin-2-one
CID 115650144
4-[[7-(4-benzylpiperidin-1-yl)-2,3-dimethylpyrrolo[2,3-c]pyridin-1-yl]methyl]-3,5-dimethyl-1,2-oxazole;hydrochloride
CID 142681082
4-(4-benzylpiperidin-1-yl)quinazoline
CID 1413843
4-(4-benzylpiperidin-1-yl)-2-chloropyridine
CID 102824003
4-(4-benzylpiperidin-1-yl)-2-phenylquinazoline
CID 10177767
4-(4-benzylpiperidin-1-yl)-2-(2-methylphenyl)pyrazolo[1,5-a]pyrazine
CID 53333763
[2-(4-benzylpiperidin-1-yl)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 1441062
4-benzyl-1-(4-methylphenyl)piperidine
CID 101028203
4-(4-benzylpiperidin-1-yl)-6-methyl-5-phenylthieno[2,3-d]pyrimidine
CID 2132383
4-(4-benzylpiperidin-1-yl)pyrimidin-5-amine
CID 79918295

Frequently Asked Questions

What is the IUPAC name of 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine (CID 11515256) is 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine is Cc1[nH]c2c(N3CCC(Cc4ccccc4)CC3)nccc2c1C.
What is the InChIKey of 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is NWYFRIQJZBDYIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3/c1-15-16(2)23-20-19(15)8-11-22-21(20)24-12-9-18(10-13-24)14-17-6-4-3-5-7-17/h3-8,11,18,23H,9-10,12-14H2,1-2H3.
What are the key properties of 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine?
7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 319.45 g/mol, XLogP of 4.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-benzylpiperidin-1-yl)-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 11515256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).