N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide

C26H33N3O5 — CID 4847857

IUPACN-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide
SMILESCOc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)ccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C26H33N3O5/c1-32-24-17-21(7-8-23(24)34-19-25(30)29-13-15-33-16-14-29)26(31)27-22-9-11-28(12-10-22)18-20-5-3-2-4-6-20/h2-8,17,22H,9-16,18-19H2,1H3,(H,27,31)
InChIKeyXTKILCSJEATALO-UHFFFAOYSA-N
MW467.57 g/mol
LogP2.33
Rot. Bonds8

About N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide

N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide (PubChem CID 4847857) has the molecular formula C26H33N3O5 and a molecular weight of 467.57 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide
PubChem CID4847857
Molecular FormulaC26H33N3O5
Molecular Weight467.57 g/mol
Exact Mass467.24
IUPAC NameN-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide
SMILESCOc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)ccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C26H33N3O5/c1-32-24-17-21(7-8-23(24)34-19-25(30)29-13-15-33-16-14-29)26(31)27-22-9-11-28(12-10-22)18-20-5-3-2-4-6-20/h2-8,17,22H,9-16,18-19H2,1H3,(H,27,31)
InChIKeyXTKILCSJEATALO-UHFFFAOYSA-N
XLogP2.33
TPSA80.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.57
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclopropyl-3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide
CID 9165476
3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoic acid
CID 2363825
N-(1-benzylpiperidin-4-yl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 29291844
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-4-ethoxy-3-methoxybenzamide
CID 8590242
3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(2-phenylphenyl)benzamide
CID 4876101
N-(1-benzylpiperidin-4-yl)-4-methoxybenzamide
CID 799331
3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoic acid
CID 5169130
4-(2-amino-2-oxoethoxy)-3-methoxy-N-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]benzamide
CID 55946135
3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide
CID 108550372
4-tert-butyl-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide
CID 108554170
4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]-3-methoxybenzoic acid
CID 22265114
4-ethoxy-N-[1-[(3-fluoro-4-methoxyphenyl)methyl]piperidin-4-yl]-3-methoxybenzamide
CID 55959016

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide (CID 4847857) is N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide is COc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)ccc1OCC(=O)N1CCOCC1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide?
The InChIKey is XTKILCSJEATALO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N3O5/c1-32-24-17-21(7-8-23(24)34-19-25(30)29-13-15-33-16-14-29)26(31)27-22-9-11-28(12-10-22)18-20-5-3-2-4-6-20/h2-8,17,22H,9-16,18-19H2,1H3,(H,27,31).
What are the key properties of N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide?
N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide has a molecular weight of 467.57 g/mol, XLogP of 2.33, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzamide is sourced from PubChem (CID 4847857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).