2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine

C15H24N2 — CID 71286312

IUPAC2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine
SMILESCC(C)(C)c1ccc(CN2CCCCC2)cn1
InChIInChI=1S/C15H24N2/c1-15(2,3)14-8-7-13(11-16-14)12-17-9-5-4-6-10-17/h7-8,11H,4-6,9-10,12H2,1-3H3
InChIKeyQKRRMSZGPORXNK-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.37
Rot. Bonds2

About 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine

2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine (PubChem CID 71286312) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine.

Molecular Properties

Compound Name2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine
PubChem CID71286312
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine
SMILESCC(C)(C)c1ccc(CN2CCCCC2)cn1
InChIInChI=1S/C15H24N2/c1-15(2,3)14-8-7-13(11-16-14)12-17-9-5-4-6-10-17/h7-8,11H,4-6,9-10,12H2,1-3H3
InChIKeyQKRRMSZGPORXNK-UHFFFAOYSA-N
XLogP3.37
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(6-tert-butyl-3-pyridinyl)methyl]piperidin-4-ol
CID 134595430
1-[4-[(6-tert-butyl-3-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
CID 134595629
(3S)-1-[(6-tert-butyl-3-pyridinyl)methyl]piperidin-3-ol
CID 134595793
1-[(6-tert-butyl-3-pyridinyl)methyl]pyrrolidine-3-carboxylic acid
CID 134595460
5-(azepan-1-ylmethyl)-N-methylpyridin-2-amine
CID 62182145
2-[(2S)-4-[(6-tert-butyl-3-pyridinyl)methyl]-2-methylpiperazin-1-yl]ethanol
CID 134595804
1-[(4-methylphenyl)methyl]azepane
CID 3951815
2-[1-[(6-tert-butyl-3-pyridinyl)methyl]-5,5-difluoroazepan-4-yl]acetic acid
CID 166288962
ethane;1-[(4-methylphenyl)methyl]piperidine
CID 143603243
5-tert-butyl-2-(piperidin-1-ylmethyl)pyrimidine
CID 158164356
5-ethyl-2-(piperidin-1-ylmethyl)pyridine
CID 58495459
1-[(6-tert-butyl-3-pyridinyl)methyl]-1,9-diazaspiro[4.5]decane
CID 166301336

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine?
The IUPAC name of 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine (CID 71286312) is 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine.
What is the SMILES notation for 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine?
The canonical SMILES for 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine is CC(C)(C)c1ccc(CN2CCCCC2)cn1.
What is the InChIKey of 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine?
The InChIKey is QKRRMSZGPORXNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-15(2,3)14-8-7-13(11-16-14)12-17-9-5-4-6-10-17/h7-8,11H,4-6,9-10,12H2,1-3H3.
What are the key properties of 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine?
2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine has a molecular weight of 232.37 g/mol, XLogP of 3.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine is sourced from PubChem (CID 71286312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).