N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide

C18H19ClN2O2 — CID 110362732

IUPACN-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cc(N2CCOCC2)ccc1Cl
InChIInChI=1S/C18H19ClN2O2/c1-13-4-2-3-5-15(13)18(22)20-17-12-14(6-7-16(17)19)21-8-10-23-11-9-21/h2-7,12H,8-11H2,1H3,(H,20,22)
InChIKeyBLYKETLNIFGHOB-UHFFFAOYSA-N
MW330.82 g/mol
LogP3.74
Rot. Bonds3

About N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide

N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide (PubChem CID 110362732) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide
PubChem CID110362732
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC NameN-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cc(N2CCOCC2)ccc1Cl
InChIInChI=1S/C18H19ClN2O2/c1-13-4-2-3-5-15(13)18(22)20-17-12-14(6-7-16(17)19)21-8-10-23-11-9-21/h2-7,12H,8-11H2,1H3,(H,20,22)
InChIKeyBLYKETLNIFGHOB-UHFFFAOYSA-N
XLogP3.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(2-morpholin-4-yl-5-pyrrolidin-1-ylphenyl)benzamide
CID 110400474
N-(2-chloro-5-morpholin-4-ylphenyl)-2,6-dimethoxybenzamide
CID 110362746
2-chloro-N-(2-chloro-5-morpholin-4-ylphenyl)acetamide
CID 43822469
N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-morpholin-4-ylbenzamide
CID 48987924
N-(5-fluoro-2-morpholin-4-ylphenyl)-2-methylbenzamide
CID 113092681
N-(5-amino-2-chlorophenyl)-2-methylbenzamide
CID 28866784
2-methyl-N-(2-morpholin-4-yl-4-nitrophenyl)benzamide
CID 17220821
2-bromo-N-(2-methoxy-5-morpholin-4-ylphenyl)benzamide
CID 110359755
5-[(2-methylbenzoyl)amino]-2-morpholin-4-ylbenzoic acid
CID 50807484
4,5-dichloro-1-methyl-N-(2-methyl-4-morpholin-4-ylphenyl)pyrrole-2-carboxamide
CID 154773651
2-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)benzamide
CID 17173694
2-fluoro-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400396

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide?
The IUPAC name of N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide (CID 110362732) is N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide.
What is the SMILES notation for N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide?
The canonical SMILES for N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide is Cc1ccccc1C(=O)Nc1cc(N2CCOCC2)ccc1Cl.
What is the InChIKey of N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide?
The InChIKey is BLYKETLNIFGHOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-13-4-2-3-5-15(13)18(22)20-17-12-14(6-7-16(17)19)21-8-10-23-11-9-21/h2-7,12H,8-11H2,1H3,(H,20,22).
What are the key properties of N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide?
N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide has a molecular weight of 330.82 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-morpholin-4-ylphenyl)-2-methylbenzamide is sourced from PubChem (CID 110362732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).