2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine

C12H18N2 — CID 139490801

IUPAC2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine
SMILESCc1cc(C[C@H]2CCCNC2)ccn1
InChIInChI=1S/C12H18N2/c1-10-7-11(4-6-14-10)8-12-3-2-5-13-9-12/h4,6-7,12-13H,2-3,5,8-9H2,1H3/t12-/m1/s1
InChIKeyAWIHMLFCQUUTKQ-GFCCVEGCSA-N
MW190.29 g/mol
LogP1.93
Rot. Bonds2

About 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine

2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine (PubChem CID 139490801) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine.

Molecular Properties

Compound Name2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine
PubChem CID139490801
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine
SMILESCc1cc(C[C@H]2CCCNC2)ccn1
InChIInChI=1S/C12H18N2/c1-10-7-11(4-6-14-10)8-12-3-2-5-13-9-12/h4,6-7,12-13H,2-3,5,8-9H2,1H3/t12-/m1/s1
InChIKeyAWIHMLFCQUUTKQ-GFCCVEGCSA-N
XLogP1.93
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3-methylphenyl)methyl]piperidine
CID 17039519
(3S)-3-[(3-methylphenyl)methyl]piperidine
CID 39345685
N,2-dimethyl-N-(piperidin-3-ylmethyl)pyridin-4-amine
CID 83837363
1-methoxy-7-(piperidin-3-ylmethyl)isoquinoline
CID 117394492
3-methyl-6-(piperidin-3-ylmethyl)quinoline
CID 116997414
3-[(3-ethyl-4-methylphenyl)methyl]piperidine
CID 84785651
2-methyl-4-(piperidin-3-ylmethyl)-6-(trifluoromethyl)pyridine
CID 146284962
7-(piperidin-3-ylmethyl)quinoline
CID 84791058
(3S)-3-[(4-methoxy-3,5-dimethylphenyl)methyl]piperidine
CID 39345701
2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine
CID 135135099
N-(2-methyl-4-pyridinyl)-3-piperidin-3-ylpropanamide
CID 79241024
2-(piperidin-3-ylmethyl)-4-propan-2-ylpyridine
CID 115009336

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine?
The IUPAC name of 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine (CID 139490801) is 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine.
What is the SMILES notation for 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine?
The canonical SMILES for 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine is Cc1cc(C[C@H]2CCCNC2)ccn1.
What is the InChIKey of 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine?
The InChIKey is AWIHMLFCQUUTKQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H18N2/c1-10-7-11(4-6-14-10)8-12-3-2-5-13-9-12/h4,6-7,12-13H,2-3,5,8-9H2,1H3/t12-/m1/s1.
What are the key properties of 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine?
2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine has a molecular weight of 190.29 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine is sourced from PubChem (CID 139490801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).