N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide

C16H24N2O3 — CID 82731920

IUPACN-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide
SMILESCCC1CCCNC1CNC(=O)c1cc(OC)ccc1O
InChIInChI=1S/C16H24N2O3/c1-3-11-5-4-8-17-14(11)10-18-16(20)13-9-12(21-2)6-7-15(13)19/h6-7,9,11,14,17,19H,3-5,8,10H2,1-2H3,(H,18,20)
InChIKeyYMWXXOTXIOVOCG-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.91
Rot. Bonds5

About N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide

N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide (PubChem CID 82731920) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide.

Molecular Properties

Compound NameN-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide
PubChem CID82731920
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide
SMILESCCC1CCCNC1CNC(=O)c1cc(OC)ccc1O
InChIInChI=1S/C16H24N2O3/c1-3-11-5-4-8-17-14(11)10-18-16(20)13-9-12(21-2)6-7-15(13)19/h6-7,9,11,14,17,19H,3-5,8,10H2,1-2H3,(H,18,20)
InChIKeyYMWXXOTXIOVOCG-UHFFFAOYSA-N
XLogP1.91
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-4-methoxybenzamide
CID 82732421
2-hydroxy-N-[(2-hydroxycyclohexyl)methyl]-5-methoxybenzamide
CID 64911532
N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide
CID 82732402
N-[(3-ethylpiperidin-2-yl)methyl]-3-methoxy-4-methylbenzamide
CID 82731476
N-[(3-ethylpiperidin-2-yl)methyl]-2-fluoro-6-hydroxybenzamide
CID 107014745
2-hydroxy-5-methoxy-N-[(4-methylpiperidin-3-yl)methyl]benzamide
CID 114955702
2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide
CID 82732420
N-[(3-ethylpiperidin-2-yl)methyl]-3-fluoro-4-methoxybenzamide
CID 82732425
N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methoxybenzamide
CID 106124081
N-[(3-ethylpiperidin-2-yl)methyl]acetamide
CID 82734521
N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide
CID 82734161
N-(azepan-4-yl)-2-hydroxy-5-methoxybenzamide
CID 107172227

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide?
The IUPAC name of N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide (CID 82731920) is N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide.
What is the SMILES notation for N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide?
The canonical SMILES for N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide is CCC1CCCNC1CNC(=O)c1cc(OC)ccc1O.
What is the InChIKey of N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide?
The InChIKey is YMWXXOTXIOVOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-3-11-5-4-8-17-14(11)10-18-16(20)13-9-12(21-2)6-7-15(13)19/h6-7,9,11,14,17,19H,3-5,8,10H2,1-2H3,(H,18,20).
What are the key properties of N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide?
N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide has a molecular weight of 292.38 g/mol, XLogP of 1.91, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide is sourced from PubChem (CID 82731920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).