2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine

C17H27N3 — CID 172524114

IUPAC2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine
SMILESCN1CCCC(c2ccc(CN3CCCCC3)cn2)C1
InChIInChI=1S/C17H27N3/c1-19-9-5-6-16(14-19)17-8-7-15(12-18-17)13-20-10-3-2-4-11-20/h7-8,12,16H,2-6,9-11,13-14H2,1H3
InChIKeyCCUOMZFUPOPQME-UHFFFAOYSA-N
MW273.42 g/mol
LogP2.88
Rot. Bonds3

About 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine

2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine (PubChem CID 172524114) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine.

Molecular Properties

Compound Name2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine
PubChem CID172524114
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC Name2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine
SMILESCN1CCCC(c2ccc(CN3CCCCC3)cn2)C1
InChIInChI=1S/C17H27N3/c1-19-9-5-6-16(14-19)17-8-7-15(12-18-17)13-20-10-3-2-4-11-20/h7-8,12,16H,2-6,9-11,13-14H2,1H3
InChIKeyCCUOMZFUPOPQME-UHFFFAOYSA-N
XLogP2.88
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[6-(1-methylpiperidin-3-yl)-3-pyridinyl]phenyl]methanol
CID 110257480
4-methyl-6-(1-methylpiperidin-3-yl)-2-(piperidin-1-ylmethyl)pyrimidine
CID 172524149
N-[[6-(1-benzylpiperidin-3-yl)-3-pyridinyl]methoxy]-N-methylmethanamine
CID 89100460
2-methyl-6-[1-[(6-methyl-3-pyridinyl)methyl]piperidin-3-yl]pyrazine
CID 110259175
2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol
CID 73440472
2-methyl-4-[(3R)-1-[(6-methyl-3-pyridinyl)methyl]piperidin-3-yl]pyrimidine
CID 124949798
[4-[(6-methoxy-3-pyridinyl)methyl]-1,4-diazepan-1-yl]-(1-methylpiperidin-3-yl)methanone
CID 134707551
2-tert-butyl-5-(piperidin-1-ylmethyl)pyridine
CID 71286312
5-(azepan-1-ylmethyl)-N-methylpyridin-2-amine
CID 62182145
5-[(4-chlorophenyl)methyl]-2-[(3R)-1-(2-phenylethyl)piperidin-3-yl]pyridine
CID 125027075
5-methyl-2-[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]pyridine
CID 110257106
N-[(1-methylpiperidin-3-yl)methyl]-4-(pyrrolidin-1-ylmethyl)aniline
CID 62655999

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine?
The IUPAC name of 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine (CID 172524114) is 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine.
What is the SMILES notation for 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine?
The canonical SMILES for 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine is CN1CCCC(c2ccc(CN3CCCCC3)cn2)C1.
What is the InChIKey of 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine?
The InChIKey is CCUOMZFUPOPQME-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-19-9-5-6-16(14-19)17-8-7-15(12-18-17)13-20-10-3-2-4-11-20/h7-8,12,16H,2-6,9-11,13-14H2,1H3.
What are the key properties of 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine?
2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine has a molecular weight of 273.42 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine is sourced from PubChem (CID 172524114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).