N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide

C18H18N4O4 — CID 136534503

IUPACN-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide
SMILESCn1c(=O)oc2cc(NC(=O)c3cc(N4CCOCC4)ccn3)ccc21
InChIInChI=1S/C18H18N4O4/c1-21-15-3-2-12(10-16(15)26-18(21)24)20-17(23)14-11-13(4-5-19-14)22-6-8-25-9-7-22/h2-5,10-11H,6-9H2,1H3,(H,20,23)
InChIKeyMSRKFECAMKWZIG-UHFFFAOYSA-N
MW354.37 g/mol
LogP1.62
Rot. Bonds3

About N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide

N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 136534503) has the molecular formula C18H18N4O4 and a molecular weight of 354.37 g/mol. Its IUPAC name is N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide
PubChem CID136534503
Molecular FormulaC18H18N4O4
Molecular Weight354.37 g/mol
Exact Mass354.13
IUPAC NameN-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide
SMILESCn1c(=O)oc2cc(NC(=O)c3cc(N4CCOCC4)ccn3)ccc21
InChIInChI=1S/C18H18N4O4/c1-21-15-3-2-12(10-16(15)26-18(21)24)20-17(23)14-11-13(4-5-19-14)22-6-8-25-9-7-22/h2-5,10-11H,6-9H2,1H3,(H,20,23)
InChIKeyMSRKFECAMKWZIG-UHFFFAOYSA-N
XLogP1.62
TPSA89.60 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.37
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-(4-methylpiperidin-1-yl)phenyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 109206689
N-(3-acetylphenyl)-4-morpholin-4-ylpyridine-2-carboxamide
CID 109206676
4-(4-methylpiperazin-1-yl)-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide
CID 109208359
N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide
CID 109202858
4-morpholin-4-yl-N-[2-(2,2,2-trifluoroethoxy)-4-pyridinyl]pyridine-2-carboxamide
CID 138043224
N-(4-acetamidophenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203936
4-(4-methylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-2-carboxamide
CID 109208362
1-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-3-(oxan-4-yl)urea
CID 110608289
N-(3,4-dimethylphenyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyridine-2-carboxamide
CID 109215686
N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 167893013
2-methyl-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)benzamide
CID 53007873
N-(3,4-difluorophenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203985

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide (CID 136534503) is N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide is Cn1c(=O)oc2cc(NC(=O)c3cc(N4CCOCC4)ccn3)ccc21.
What is the InChIKey of N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is MSRKFECAMKWZIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4/c1-21-15-3-2-12(10-16(15)26-18(21)24)20-17(23)14-11-13(4-5-19-14)22-6-8-25-9-7-22/h2-5,10-11H,6-9H2,1H3,(H,20,23).
What are the key properties of N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide?
N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 354.37 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 136534503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).