(2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone

C14H19NO3 — CID 114221152

IUPAC(2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone
SMILESCOC1CCN(C(=O)c2ccccc2O)C(C)C1
InChIInChI=1S/C14H19NO3/c1-10-9-11(18-2)7-8-15(10)14(17)12-5-3-4-6-13(12)16/h3-6,10-11,16H,7-9H2,1-2H3
InChIKeyGWUHPWGJIRVTCW-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.03
Rot. Bonds2

About (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone

(2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone (PubChem CID 114221152) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone
PubChem CID114221152
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Name(2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone
SMILESCOC1CCN(C(=O)c2ccccc2O)C(C)C1
InChIInChI=1S/C14H19NO3/c1-10-9-11(18-2)7-8-15(10)14(17)12-5-3-4-6-13(12)16/h3-6,10-11,16H,7-9H2,1-2H3
InChIKeyGWUHPWGJIRVTCW-UHFFFAOYSA-N
XLogP2.03
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-hydroxyphenyl)-(2-methylpiperidin-1-yl)methanone
CID 43186537
(6-hydrazinyl-3-pyridinyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone
CID 114221536
4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one
CID 114221445
ethane;methyl 4-methoxy-2-methylpiperidine-1-carboxylate
CID 164564582
(4-amino-2-pyridinyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone
CID 114221525
1-(2-hydroxy-4-methoxybenzoyl)-2-methylpiperidine-4-carboxylic acid
CID 106741876
1-(2-bromobenzoyl)-2-methylpiperidine-4-carboxylic acid
CID 106741861
2-(4-methoxypiperidine-1-carbonyl)benzoic acid
CID 43372663
1-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2-(2-hydroxyphenyl)ethanone
CID 115963360
(3-hydroxy-2-methylphenyl)-(4-methoxypiperidin-1-yl)methanone
CID 82829162
(2R,3R)-1-(2-hydroxybenzoyl)-2-methylpiperidine-3-carboxylic acid
CID 122116461
(2,4-dimethylpiperidin-1-yl)-(2-hydroxy-5-iodophenyl)methanone
CID 103522096

Frequently Asked Questions

What is the IUPAC name of (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone?
The IUPAC name of (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone (CID 114221152) is (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone?
The canonical SMILES for (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone is COC1CCN(C(=O)c2ccccc2O)C(C)C1.
What is the InChIKey of (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone?
The InChIKey is GWUHPWGJIRVTCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-10-9-11(18-2)7-8-15(10)14(17)12-5-3-4-6-13(12)16/h3-6,10-11,16H,7-9H2,1-2H3.
What are the key properties of (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone?
(2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone has a molecular weight of 249.31 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxyphenyl)-(4-methoxy-2-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 114221152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).