ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine

C16H28N2O — CID 171082468

IUPACethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine
SMILESCC.COc1ccc(CCC2CCN(C)CC2)nc1
InChIInChI=1S/C14H22N2O.C2H6/c1-16-9-7-12(8-10-16)3-4-13-5-6-14(17-2)11-15-13;1-2/h5-6,11-12H,3-4,7-10H2,1-2H3;1-2H3
InChIKeyFNCXFGZKNOYHQE-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.39
Rot. Bonds4

About ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine

ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine (PubChem CID 171082468) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine.

Molecular Properties

Compound Nameethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine
PubChem CID171082468
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Nameethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine
SMILESCC.COc1ccc(CCC2CCN(C)CC2)nc1
InChIInChI=1S/C14H22N2O.C2H6/c1-16-9-7-12(8-10-16)3-4-13-5-6-14(17-2)11-15-13;1-2/h5-6,11-12H,3-4,7-10H2,1-2H3;1-2H3
InChIKeyFNCXFGZKNOYHQE-UHFFFAOYSA-N
XLogP3.39
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-[2-(4-methoxyphenyl)ethyl]-1-methylpyrrolidine
CID 150264737
5-methoxy-2-propylpyridine
CID 129127600
2-(5-methoxy-2-pyridinyl)ethanamine;hydrochloride
CID 86280253
1-[[6-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]-3-pyridinyl]sulfonyl]-4-methylpiperazine
CID 17425757
6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine
CID 117137929
5-methoxy-2-[[(3R)-pyrrolidin-3-yl]methyl]pyridine
CID 146288202
5-[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]pyridine-2-carbonitrile
CID 133369795
[6-[2-(4-butylcyclohexyl)ethyl]-3-pyridinyl] 4-propoxybenzoate
CID 150100464
2-(4-methoxyphenyl)-N-[(1-methylpiperidin-4-yl)methyl]-N-(pyridin-3-ylmethyl)ethanamine
CID 25289668
N-(2,4-dimethoxyphenyl)-2-(1-methylpiperidin-4-yl)acetamide
CID 95969570
1-methyl-4-[(4-methylphenoxy)methyl]piperidine
CID 123249578
5-(1-methylpiperidin-4-yl)oxypyridin-2-amine
CID 71565292

Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine?
The IUPAC name of ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine (CID 171082468) is ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine.
What is the SMILES notation for ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine?
The canonical SMILES for ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine is CC.COc1ccc(CCC2CCN(C)CC2)nc1.
What is the InChIKey of ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine?
The InChIKey is FNCXFGZKNOYHQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O.C2H6/c1-16-9-7-12(8-10-16)3-4-13-5-6-14(17-2)11-15-13;1-2/h5-6,11-12H,3-4,7-10H2,1-2H3;1-2H3.
What are the key properties of ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine?
ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine has a molecular weight of 264.41 g/mol, XLogP of 3.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxy-2-[2-(1-methylpiperidin-4-yl)ethyl]pyridine is sourced from PubChem (CID 171082468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).