3-[3-(4-methylphenyl)piperidin-4-yl]pyridine

C17H20N2 — CID 79441307

IUPAC3-[3-(4-methylphenyl)piperidin-4-yl]pyridine
SMILESCc1ccc(C2CNCCC2c2cccnc2)cc1
InChIInChI=1S/C17H20N2/c1-13-4-6-14(7-5-13)17-12-19-10-8-16(17)15-3-2-9-18-11-15/h2-7,9,11,16-17,19H,8,10,12H2,1H3
InChIKeyVWFHAGGKQMPCAO-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.25
Rot. Bonds2

About 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine

3-[3-(4-methylphenyl)piperidin-4-yl]pyridine (PubChem CID 79441307) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine.

Molecular Properties

Compound Name3-[3-(4-methylphenyl)piperidin-4-yl]pyridine
PubChem CID79441307
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name3-[3-(4-methylphenyl)piperidin-4-yl]pyridine
SMILESCc1ccc(C2CNCCC2c2cccnc2)cc1
InChIInChI=1S/C17H20N2/c1-13-4-6-14(7-5-13)17-12-19-10-8-16(17)15-3-2-9-18-11-15/h2-7,9,11,16-17,19H,8,10,12H2,1H3
InChIKeyVWFHAGGKQMPCAO-UHFFFAOYSA-N
XLogP3.25
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[3-(4-methylphenyl)piperidin-4-yl]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

3-[3-(4-chlorophenyl)piperidin-4-yl]pyridine
CID 79434183
3-[3-(2-chlorophenyl)piperidin-4-yl]pyridine
CID 79454588
4-(3-methoxyphenyl)-3-(4-methylphenyl)piperidine
CID 79432555
3-pyrrolidin-3-ylpyridine
CID 3613651
4-(3-methylphenyl)-3-phenylpiperidine
CID 79312119
1-(4-methylphenyl)-2-pyridin-3-ylpiperazine
CID 82131866
2-pyridin-3-ylpiperazine
CID 3872289
3-[2-(4-phenylphenyl)cyclohexyl]pyridine
CID 175611155
(3-pyridin-3-ylpyrrolidin-2-yl)methanol
CID 126982382
4-(2-ethylphenyl)-3-(4-methylphenyl)piperidine
CID 79432342
4-(3-chloro-4-methylphenyl)-3-phenylpiperidine
CID 106819222
3-[(2S)-aziridin-2-yl]pyridine
CID 55263397

Frequently Asked Questions

What is the IUPAC name of 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine?
The IUPAC name of 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine (CID 79441307) is 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine.
What is the SMILES notation for 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine?
The canonical SMILES for 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine is Cc1ccc(C2CNCCC2c2cccnc2)cc1.
What is the InChIKey of 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine?
The InChIKey is VWFHAGGKQMPCAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-13-4-6-14(7-5-13)17-12-19-10-8-16(17)15-3-2-9-18-11-15/h2-7,9,11,16-17,19H,8,10,12H2,1H3.
What are the key properties of 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine?
3-[3-(4-methylphenyl)piperidin-4-yl]pyridine has a molecular weight of 252.36 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(4-methylphenyl)piperidin-4-yl]pyridine is sourced from PubChem (CID 79441307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).