3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide

C15H22N2O3 — CID 79726061

IUPAC3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide
SMILESCOc1ccc(C(=O)NC(C)C2CCCCN2)cc1O
InChIInChI=1S/C15H22N2O3/c1-10(12-5-3-4-8-16-12)17-15(19)11-6-7-14(20-2)13(18)9-11/h6-7,9-10,12,16,18H,3-5,8H2,1-2H3,(H,17,19)
InChIKeyDKLCELXHWANMIS-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.66
Rot. Bonds4

About 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide

3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide (PubChem CID 79726061) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide
PubChem CID79726061
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide
SMILESCOc1ccc(C(=O)NC(C)C2CCCCN2)cc1O
InChIInChI=1S/C15H22N2O3/c1-10(12-5-3-4-8-16-12)17-15(19)11-6-7-14(20-2)13(18)9-11/h6-7,9-10,12,16,18H,3-5,8H2,1-2H3,(H,17,19)
InChIKeyDKLCELXHWANMIS-UHFFFAOYSA-N
XLogP1.66
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyclopentylethyl)-3-hydroxy-4-methoxybenzamide
CID 79672563
2-hydroxy-3-methoxy-N-(1-piperidin-2-ylethyl)benzamide
CID 43523294
4-methylsulfonyl-N-(1-piperidin-2-ylethyl)benzamide
CID 43523360
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-hydroxy-4-methoxybenzamide
CID 79589931
N-cyclohexyl-3-hydroxy-4-methoxybenzamide
CID 79600190
3-hydroxy-N-(1-hydroxypropan-2-yl)-4-methoxybenzamide
CID 79732831
3-hydroxy-4-methoxy-N-piperidin-4-ylbenzamide
CID 79725951
3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 115674973
3-bromo-N-(1-cyclohexylethyl)-4-methoxybenzamide
CID 62407763
2-ethoxy-N-(1-piperidin-2-ylethyl)benzamide
CID 43523339
3-hydroxy-4-methoxy-N-(piperidin-4-ylmethyl)benzamide
CID 79725483
3-hydroxy-4-methoxy-N-methyl-N-(2-piperidin-2-ylethyl)benzamide
CID 79737443

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide?
The IUPAC name of 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide (CID 79726061) is 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide.
What is the SMILES notation for 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide?
The canonical SMILES for 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide is COc1ccc(C(=O)NC(C)C2CCCCN2)cc1O.
What is the InChIKey of 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide?
The InChIKey is DKLCELXHWANMIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-10(12-5-3-4-8-16-12)17-15(19)11-6-7-14(20-2)13(18)9-11/h6-7,9-10,12,16,18H,3-5,8H2,1-2H3,(H,17,19).
What are the key properties of 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide?
3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide has a molecular weight of 278.35 g/mol, XLogP of 1.66, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-methoxy-N-(1-piperidin-2-ylethyl)benzamide is sourced from PubChem (CID 79726061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).