4-(3-methoxyphenyl)-1-methylpiperidine

C13H19NO — CID 3030189

IUPAC4-(3-methoxyphenyl)-1-methylpiperidine
SMILESCOc1cccc(C2CCN(C)CC2)c1
InChIInChI=1S/C13H19NO/c1-14-8-6-11(7-9-14)12-4-3-5-13(10-12)15-2/h3-5,10-11H,6-9H2,1-2H3
InChIKeyTYSWSYPHKOIZFM-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.50
Rot. Bonds2

About 4-(3-methoxyphenyl)-1-methylpiperidine

4-(3-methoxyphenyl)-1-methylpiperidine (PubChem CID 3030189) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-1-methylpiperidine.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-1-methylpiperidine
PubChem CID3030189
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name4-(3-methoxyphenyl)-1-methylpiperidine
SMILESCOc1cccc(C2CCN(C)CC2)c1
InChIInChI=1S/C13H19NO/c1-14-8-6-11(7-9-14)12-4-3-5-13(10-12)15-2/h3-5,10-11H,6-9H2,1-2H3
InChIKeyTYSWSYPHKOIZFM-UHFFFAOYSA-N
XLogP2.50
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-3-methoxybenzene;methane
CID 169265234
carbanide;1-cyclopropyl-3-methoxybenzene;tungsten
CID 169265135
1-cyclopropyl-3-methoxybenzene;methanol
CID 70274289
(1R)-8-cyclopropyl-1-(3-methoxyphenyl)-5-methyl-1,3,4,6-tetrahydro-2,5-benzoxazocine
CID 11848228
(1S)-8-cyclopropyl-1-(3-methoxyphenyl)-5-methyl-1,3,4,6-tetrahydro-2,5-benzoxazocine
CID 11848241
cyclopropyl-[4-(3-methoxyphenyl)piperidin-1-yl]methanone
CID 51003388
2-[4-(3-methoxyphenyl)piperidin-1-yl]acetic acid
CID 18184335
1-methoxy-3-(4-methylidenecyclohexyl)benzene
CID 89380194
4-[4-(3-methoxyphenyl)piperidin-1-yl]butanoic acid
CID 119135089
2-methoxy-1-[4-(3-methoxyphenyl)piperidin-1-yl]ethanone
CID 110479220
2-(3-methoxyphenyl)-1,3-dimethylimidazolidine
CID 14361742
4-[3-(azetidin-3-yl)phenyl]-1-methylpiperidine
CID 116988876

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-1-methylpiperidine?
The IUPAC name of 4-(3-methoxyphenyl)-1-methylpiperidine (CID 3030189) is 4-(3-methoxyphenyl)-1-methylpiperidine.
What is the SMILES notation for 4-(3-methoxyphenyl)-1-methylpiperidine?
The canonical SMILES for 4-(3-methoxyphenyl)-1-methylpiperidine is COc1cccc(C2CCN(C)CC2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-1-methylpiperidine?
The InChIKey is TYSWSYPHKOIZFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-14-8-6-11(7-9-14)12-4-3-5-13(10-12)15-2/h3-5,10-11H,6-9H2,1-2H3.
What are the key properties of 4-(3-methoxyphenyl)-1-methylpiperidine?
4-(3-methoxyphenyl)-1-methylpiperidine has a molecular weight of 205.30 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-1-methylpiperidine is sourced from PubChem (CID 3030189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).