2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide

C16H24N2O3 — CID 120888662

IUPAC2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide
SMILESCOCC1(CNC(=O)c2ccccc2OC)CCNCC1
InChIInChI=1S/C16H24N2O3/c1-20-12-16(7-9-17-10-8-16)11-18-15(19)13-5-3-4-6-14(13)21-2/h3-6,17H,7-12H2,1-2H3,(H,18,19)
InChIKeySSSQQESKHCYHGG-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.44
Rot. Bonds6

About 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide

2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide (PubChem CID 120888662) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide
PubChem CID120888662
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide
SMILESCOCC1(CNC(=O)c2ccccc2OC)CCNCC1
InChIInChI=1S/C16H24N2O3/c1-20-12-16(7-9-17-10-8-16)11-18-15(19)13-5-3-4-6-14(13)21-2/h3-6,17H,7-12H2,1-2H3,(H,18,19)
InChIKeySSSQQESKHCYHGG-UHFFFAOYSA-N
XLogP1.44
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide?
The IUPAC name of 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide (CID 120888662) is 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide?
The canonical SMILES for 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide is COCC1(CNC(=O)c2ccccc2OC)CCNCC1.
What is the InChIKey of 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide?
The InChIKey is SSSQQESKHCYHGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-20-12-16(7-9-17-10-8-16)11-18-15(19)13-5-3-4-6-14(13)21-2/h3-6,17H,7-12H2,1-2H3,(H,18,19).
What are the key properties of 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide?
2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide has a molecular weight of 292.38 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide is sourced from PubChem (CID 120888662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).