2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide

C12H14Cl2N2O2 — CID 113287074

IUPAC2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide
SMILESO=C(NCC1CNCCO1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H14Cl2N2O2/c13-9-2-1-3-10(14)11(9)12(17)16-7-8-6-15-4-5-18-8/h1-3,8,15H,4-7H2,(H,16,17)
InChIKeyJTVCHQWYMYWIJN-UHFFFAOYSA-N
MW289.16 g/mol
LogP1.71
Rot. Bonds3

About 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide

2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide (PubChem CID 113287074) has the molecular formula C12H14Cl2N2O2 and a molecular weight of 289.16 g/mol. Its IUPAC name is 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide
PubChem CID113287074
Molecular FormulaC12H14Cl2N2O2
Molecular Weight289.16 g/mol
Exact Mass288.04
IUPAC Name2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide
SMILESO=C(NCC1CNCCO1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H14Cl2N2O2/c13-9-2-1-3-10(14)11(9)12(17)16-7-8-6-15-4-5-18-8/h1-3,8,15H,4-7H2,(H,16,17)
InChIKeyJTVCHQWYMYWIJN-UHFFFAOYSA-N
XLogP1.71
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.16
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-2,5-difluoro-N-(morpholin-2-ylmethyl)benzamide
CID 82772508
5-chloro-2-hydroxy-N-(morpholin-2-ylmethyl)benzamide
CID 115323836
4-chloro-2-methyl-N-(morpholin-2-ylmethyl)benzamide
CID 114028076
3-bromo-2-fluoro-N-(morpholin-2-ylmethyl)benzamide
CID 107956293
2-(2-methylphenyl)-N-(morpholin-2-ylmethyl)acetamide
CID 43602980
N-(morpholin-2-ylmethyl)pyridazine-4-carboxamide
CID 104671734
N-(morpholin-2-ylmethyl)pyrimidine-5-carboxamide
CID 102922356
7-bromo-N-(morpholin-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 115323833
2,6-dichloro-N-[4-[(2R)-morpholin-2-yl]phenyl]benzamide
CID 129387150
2,3-dichloro-N-(morpholin-2-ylmethyl)-5-nitrobenzamide
CID 107192102
2-(3-chlorophenoxy)-N-(morpholin-2-ylmethyl)propanamide
CID 115323843
2-(difluoromethoxy)-N-(morpholin-2-ylmethyl)benzamide
CID 43602974

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide?
The IUPAC name of 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide (CID 113287074) is 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide.
What is the SMILES notation for 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide?
The canonical SMILES for 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide is O=C(NCC1CNCCO1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide?
The InChIKey is JTVCHQWYMYWIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N2O2/c13-9-2-1-3-10(14)11(9)12(17)16-7-8-6-15-4-5-18-8/h1-3,8,15H,4-7H2,(H,16,17).
What are the key properties of 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide?
2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide has a molecular weight of 289.16 g/mol, XLogP of 1.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(morpholin-2-ylmethyl)benzamide is sourced from PubChem (CID 113287074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).