N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide

C19H21N3O4 — CID 157018336

IUPACN-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide
SMILESCOc1c(NC(=O)c2ccc(C(=O)N3CCOCC3)cc2)ccnc1C
InChIInChI=1S/C19H21N3O4/c1-13-17(25-2)16(7-8-20-13)21-18(23)14-3-5-15(6-4-14)19(24)22-9-11-26-12-10-22/h3-8H,9-12H2,1-2H3,(H,20,21,23)
InChIKeyQDWFBZRNZBOQQK-UHFFFAOYSA-N
MW355.39 g/mol
LogP2.12
Rot. Bonds4

About N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide

N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide (PubChem CID 157018336) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide.

Molecular Properties

Compound NameN-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide
PubChem CID157018336
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC NameN-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide
SMILESCOc1c(NC(=O)c2ccc(C(=O)N3CCOCC3)cc2)ccnc1C
InChIInChI=1S/C19H21N3O4/c1-13-17(25-2)16(7-8-20-13)21-18(23)14-3-5-15(6-4-14)19(24)22-9-11-26-12-10-22/h3-8H,9-12H2,1-2H3,(H,20,21,23)
InChIKeyQDWFBZRNZBOQQK-UHFFFAOYSA-N
XLogP2.12
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide?
The IUPAC name of N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide (CID 157018336) is N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide.
What is the SMILES notation for N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide?
The canonical SMILES for N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide is COc1c(NC(=O)c2ccc(C(=O)N3CCOCC3)cc2)ccnc1C.
What is the InChIKey of N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide?
The InChIKey is QDWFBZRNZBOQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c1-13-17(25-2)16(7-8-20-13)21-18(23)14-3-5-15(6-4-14)19(24)22-9-11-26-12-10-22/h3-8H,9-12H2,1-2H3,(H,20,21,23).
What are the key properties of N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide?
N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide has a molecular weight of 355.39 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-2-methyl-4-pyridinyl)-4-(morpholine-4-carbonyl)benzamide is sourced from PubChem (CID 157018336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).