(3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine

C14H21N — CID 51531591

IUPAC(3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine
SMILESCc1ccc(CN2CCC[C@@H](C)C2)cc1
InChIInChI=1S/C14H21N/c1-12-5-7-14(8-6-12)11-15-9-3-4-13(2)10-15/h5-8,13H,3-4,9-11H2,1-2H3/t13-/m1/s1
InChIKeyHBWJNCKAGPEKCJ-CYBMUJFWSA-N
MW203.33 g/mol
LogP3.23
Rot. Bonds2

About (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine

(3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine (PubChem CID 51531591) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine.

Molecular Properties

Compound Name(3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine
PubChem CID51531591
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name(3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine
SMILESCc1ccc(CN2CCC[C@@H](C)C2)cc1
InChIInChI=1S/C14H21N/c1-12-5-7-14(8-6-12)11-15-9-3-4-13(2)10-15/h5-8,13H,3-4,9-11H2,1-2H3/t13-/m1/s1
InChIKeyHBWJNCKAGPEKCJ-CYBMUJFWSA-N
XLogP3.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine 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

(3R)-1-[(4-fluorophenyl)methyl]-3-methylpiperidine
CID 51531587
4-[[(3S)-3-methylpiperidin-1-yl]methyl]aniline
CID 28720719
1-benzyl-3-methylpiperidine
CID 2794856
(3S)-1-[(4-tert-butylphenyl)methyl]-3-methylpiperidine
CID 158164357
3-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidine
CID 58659547
4-[(3-methylpiperidin-1-yl)methyl]pyridine
CID 121401070
N-methyl-N-[(4-methylphenyl)methyl]-4-[[(3S)-3-methylpiperidin-1-yl]methyl]benzamide
CID 30379432
1-[(4-methylphenyl)methyl]-N-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]piperidine-3-carboxamide
CID 43917349
2-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]acetonitrile
CID 82135670
4-[[(3R)-3-methylpiperidin-1-yl]methyl]benzaldehyde
CID 97294025
4-[[(3S)-3-methylpiperidin-1-yl]methyl]benzaldehyde
CID 97294026
1-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]ethanone
CID 142372799

Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine?
The IUPAC name of (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine (CID 51531591) is (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine.
What is the SMILES notation for (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine?
The canonical SMILES for (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine is Cc1ccc(CN2CCC[C@@H](C)C2)cc1.
What is the InChIKey of (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine?
The InChIKey is HBWJNCKAGPEKCJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H21N/c1-12-5-7-14(8-6-12)11-15-9-3-4-13(2)10-15/h5-8,13H,3-4,9-11H2,1-2H3/t13-/m1/s1.
What are the key properties of (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine?
(3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine has a molecular weight of 203.33 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine is sourced from PubChem (CID 51531591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).