N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide

C20H20N2O3 — CID 131952544

IUPACN-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide
SMILESCc1cc2cc(NC(=O)c3ccccc3N3CCOCC3)ccc2o1
InChIInChI=1S/C20H20N2O3/c1-14-12-15-13-16(6-7-19(15)25-14)21-20(23)17-4-2-3-5-18(17)22-8-10-24-11-9-22/h2-7,12-13H,8-11H2,1H3,(H,21,23)
InChIKeyJNFYBUCGDOIHTE-UHFFFAOYSA-N
MW336.39 g/mol
LogP3.83
Rot. Bonds3

About N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide

N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide (PubChem CID 131952544) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide.

Molecular Properties

Compound NameN-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide
PubChem CID131952544
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC NameN-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide
SMILESCc1cc2cc(NC(=O)c3ccccc3N3CCOCC3)ccc2o1
InChIInChI=1S/C20H20N2O3/c1-14-12-15-13-16(6-7-19(15)25-14)21-20(23)17-4-2-3-5-18(17)22-8-10-24-11-9-22/h2-7,12-13H,8-11H2,1H3,(H,21,23)
InChIKeyJNFYBUCGDOIHTE-UHFFFAOYSA-N
XLogP3.83
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(4-methoxyphenoxy)phenyl]-2-morpholin-4-ylbenzamide
CID 131937049
5-[(2-methylbenzoyl)amino]-2-morpholin-4-ylbenzoic acid
CID 50807484
2-methyl-N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylpropanamide
CID 131905130
N-(3-chloro-4-morpholin-4-ylphenyl)-2,5-dimethylfuran-3-carboxamide
CID 2811743
2-morpholin-4-ylbenzohydrazide
CID 7148386
2-bromo-N-(3-bromo-4-morpholin-4-ylphenyl)benzamide
CID 17220671
ethyl 5-[(2-methoxybenzoyl)amino]-2-morpholin-4-ylbenzoate;hydrochloride
CID 163326534
N-[4-[2-(cyclopropylamino)-2-oxoethyl]phenyl]-2-morpholin-4-ylbenzamide
CID 131939372
propyl 5-[(2-methylbenzoyl)amino]-2-morpholin-4-ylbenzoate
CID 7328823
ethyl 5-[(5-bromo-2-chlorobenzoyl)amino]-2-morpholin-4-ylbenzoate
CID 4907817
5-bromo-2-chloro-N-(3-chloro-4-morpholin-4-ylphenyl)benzamide
CID 3540597
methyl N-(2-methyl-1-benzofuran-5-yl)carbamate
CID 154667051

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide?
The IUPAC name of N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide (CID 131952544) is N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide.
What is the SMILES notation for N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide?
The canonical SMILES for N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide is Cc1cc2cc(NC(=O)c3ccccc3N3CCOCC3)ccc2o1.
What is the InChIKey of N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide?
The InChIKey is JNFYBUCGDOIHTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c1-14-12-15-13-16(6-7-19(15)25-14)21-20(23)17-4-2-3-5-18(17)22-8-10-24-11-9-22/h2-7,12-13H,8-11H2,1H3,(H,21,23).
What are the key properties of N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide?
N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide has a molecular weight of 336.39 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-benzofuran-5-yl)-2-morpholin-4-ylbenzamide is sourced from PubChem (CID 131952544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).