(2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone

C14H19NO2 — CID 5149560

IUPAC(2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone
SMILESCOc1ccccc1C(=O)N1CCC(C)CC1
InChIInChI=1S/C14H19NO2/c1-11-7-9-15(10-8-11)14(16)12-5-3-4-6-13(12)17-2/h3-6,11H,7-10H2,1-2H3
InChIKeyJJGVGKONRYWSEW-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.57
Rot. Bonds2

About (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone

(2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone (PubChem CID 5149560) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone
PubChem CID5149560
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name(2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone
SMILESCOc1ccccc1C(=O)N1CCC(C)CC1
InChIInChI=1S/C14H19NO2/c1-11-7-9-15(10-8-11)14(16)12-5-3-4-6-13(12)17-2/h3-6,11H,7-10H2,1-2H3
InChIKeyJJGVGKONRYWSEW-UHFFFAOYSA-N
XLogP2.57
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-hydroxy-3-methoxyphenyl)-(4-methylazepan-1-yl)methanone
CID 62045617
[(3R)-3-hydroxypyrrolidin-1-yl]-(2-methoxyphenyl)methanone
CID 10560934
(2-methoxyphenyl)-[4-(methylaminomethyl)piperidin-1-yl]methanone
CID 63248507
[4-(4-hydroxyphenyl)piperidin-1-yl]-(2-methoxyphenyl)methanone
CID 51327321
(2-methoxyphenyl)-[4-[(1R,3S)-3-methylcyclohexyl]piperazin-1-yl]methanone
CID 796507
(4-cyclopentylpiperazin-1-yl)-(2-methoxyphenyl)methanone
CID 796432
(2-methoxyphenyl)-[4-(methylsulfonylmethyl)piperidin-1-yl]methanone
CID 110736037
(4-amino-3-methylpiperidin-1-yl)-(2-methoxyphenyl)methanone;hydrochloride
CID 119592557
methyl 1-(2-methoxybenzoyl)pyrrolidine-3-carboxylate
CID 84581536
[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]-(2-methoxyphenyl)methanone
CID 129367623
(2-methoxyphenyl)-[4-(2-phenylethyl)piperidin-1-yl]methanone
CID 24720426
1-cyclohexyl-3-[1-(2-methoxybenzoyl)piperidin-4-yl]urea
CID 127232346

Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone (CID 5149560) is (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone is COc1ccccc1C(=O)N1CCC(C)CC1.
What is the InChIKey of (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone?
The InChIKey is JJGVGKONRYWSEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-11-7-9-15(10-8-11)14(16)12-5-3-4-6-13(12)17-2/h3-6,11H,7-10H2,1-2H3.
What are the key properties of (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone?
(2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone has a molecular weight of 233.31 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 5149560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).