2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide

C19H29N3O2 — CID 70846032

IUPAC2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide
SMILESCc1ccc(CN2CCOCC2)cc1C(=O)NC1CCN(C)CC1
InChIInChI=1S/C19H29N3O2/c1-15-3-4-16(14-22-9-11-24-12-10-22)13-18(15)19(23)20-17-5-7-21(2)8-6-17/h3-4,13,17H,5-12,14H2,1-2H3,(H,20,23)
InChIKeyUELKOWMHLBMAFU-UHFFFAOYSA-N
MW331.46 g/mol
LogP1.65
Rot. Bonds4

About 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide

2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide (PubChem CID 70846032) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide
PubChem CID70846032
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC Name2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide
SMILESCc1ccc(CN2CCOCC2)cc1C(=O)NC1CCN(C)CC1
InChIInChI=1S/C19H29N3O2/c1-15-3-4-16(14-22-9-11-24-12-10-22)13-18(15)19(23)20-17-5-7-21(2)8-6-17/h3-4,13,17H,5-12,14H2,1-2H3,(H,20,23)
InChIKeyUELKOWMHLBMAFU-UHFFFAOYSA-N
XLogP1.65
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(oxan-4-yl)-5-(pyrrolidin-1-ylmethyl)benzamide
CID 70845853
2-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-(morpholin-4-ylmethyl)benzamide
CID 70845924
5-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-2-methyl-N-(oxan-4-yl)benzamide
CID 70845852
2-methyl-5-(morpholin-4-ylmethyl)-N-(oxolan-3-ylmethyl)benzamide
CID 70845928
2-methyl-5-(morpholin-4-ylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 70846212
5-bromo-2-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 65306983
N,2-dimethyl-5-[(4-methylpiperazin-1-yl)methyl]benzamide
CID 67106005
1-[2-methyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-(oxan-4-yl)ethanone
CID 157306935
5-[[2-(dimethylamino)ethyl-methylamino]methyl]-2-methyl-N-(oxan-4-yl)benzamide
CID 70845942
5-amino-2-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 120640346
N-[1-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-yl]-2-methylbenzamide
CID 110009371
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-methylbenzamide
CID 18121058

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide?
The IUPAC name of 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide (CID 70846032) is 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide.
What is the SMILES notation for 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide?
The canonical SMILES for 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide is Cc1ccc(CN2CCOCC2)cc1C(=O)NC1CCN(C)CC1.
What is the InChIKey of 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide?
The InChIKey is UELKOWMHLBMAFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-15-3-4-16(14-22-9-11-24-12-10-22)13-18(15)19(23)20-17-5-7-21(2)8-6-17/h3-4,13,17H,5-12,14H2,1-2H3,(H,20,23).
What are the key properties of 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide?
2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide has a molecular weight of 331.46 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methylpiperidin-4-yl)-5-(morpholin-4-ylmethyl)benzamide is sourced from PubChem (CID 70846032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).