2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide

C24H24N2O3 — CID 108549225

IUPAC2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide
SMILESCOc1ccccc1C(=O)NC1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C24H24N2O3/c1-29-22-12-5-4-10-21(22)23(27)25-18-13-15-26(16-14-18)24(28)20-11-6-8-17-7-2-3-9-19(17)20/h2-12,18H,13-16H2,1H3,(H,25,27)
InChIKeyMRXLXLDYOGRLCT-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.88
Rot. Bonds4

About 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide

2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide (PubChem CID 108549225) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide
PubChem CID108549225
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide
SMILESCOc1ccccc1C(=O)NC1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C24H24N2O3/c1-29-22-12-5-4-10-21(22)23(27)25-18-13-15-26(16-14-18)24(28)20-11-6-8-17-7-2-3-9-19(17)20/h2-12,18H,13-16H2,1H3,(H,25,27)
InChIKeyMRXLXLDYOGRLCT-UHFFFAOYSA-N
XLogP3.88
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide (CID 108549225) is 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide is COc1ccccc1C(=O)NC1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide?
The InChIKey is MRXLXLDYOGRLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-29-22-12-5-4-10-21(22)23(27)25-18-13-15-26(16-14-18)24(28)20-11-6-8-17-7-2-3-9-19(17)20/h2-12,18H,13-16H2,1H3,(H,25,27).
What are the key properties of 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide?
2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide has a molecular weight of 388.47 g/mol, XLogP of 3.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 108549225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).