N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide

C19H17N3O4 — CID 47020558

IUPACN-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cn1)c1cc2ccccc2oc1=O
InChIInChI=1S/C19H17N3O4/c23-18(15-11-13-3-1-2-4-16(13)26-19(15)24)21-17-6-5-14(12-20-17)22-7-9-25-10-8-22/h1-6,11-12H,7-10H2,(H,20,21,23)
InChIKeyFXDHYNLHRGXACH-UHFFFAOYSA-N
MW351.36 g/mol
LogP2.28
Rot. Bonds3

About N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide

N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide (PubChem CID 47020558) has the molecular formula C19H17N3O4 and a molecular weight of 351.36 g/mol. Its IUPAC name is N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide.

Molecular Properties

Compound NameN-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide
PubChem CID47020558
Molecular FormulaC19H17N3O4
Molecular Weight351.36 g/mol
Exact Mass351.12
IUPAC NameN-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cn1)c1cc2ccccc2oc1=O
InChIInChI=1S/C19H17N3O4/c23-18(15-11-13-3-1-2-4-16(13)26-19(15)24)21-17-6-5-14(12-20-17)22-7-9-25-10-8-22/h1-6,11-12H,7-10H2,(H,20,21,23)
InChIKeyFXDHYNLHRGXACH-UHFFFAOYSA-N
XLogP2.28
TPSA84.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.36
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

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Related Compounds

N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide
CID 134053222
2-oxo-N-(4-pyrrolidin-1-ylphenyl)chromene-3-carboxamide
CID 51157990
5-bromo-N-(5-morpholin-4-yl-2-pyridinyl)-1-benzofuran-2-carboxamide
CID 55651490
N-[4-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]phenyl]-2-oxochromene-3-carboxamide
CID 46267998
[2-(4-morpholin-4-ylanilino)-2-oxoethyl] 2-oxochromene-3-carboxylate
CID 7752429
3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 38139828
4-fluoro-3,5-dimethyl-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 146084918
2-(difluoromethoxy)-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 25345280
5-methyl-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide
CID 38139634
N-[4-(4-methoxypiperidin-1-yl)phenyl]-2-oxochromene-3-carboxamide
CID 90595706
N-[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]-2-oxochromene-3-carboxamide
CID 94813486
7-morpholin-4-yl-2-oxochromene-3-carboxylic acid
CID 3469110

Frequently Asked Questions

What is the IUPAC name of N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide?
The IUPAC name of N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide (CID 47020558) is N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide.
What is the SMILES notation for N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide?
The canonical SMILES for N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide is O=C(Nc1ccc(N2CCOCC2)cn1)c1cc2ccccc2oc1=O.
What is the InChIKey of N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide?
The InChIKey is FXDHYNLHRGXACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O4/c23-18(15-11-13-3-1-2-4-16(13)26-19(15)24)21-17-6-5-14(12-20-17)22-7-9-25-10-8-22/h1-6,11-12H,7-10H2,(H,20,21,23).
What are the key properties of N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide?
N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide has a molecular weight of 351.36 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-morpholin-4-yl-2-pyridinyl)-2-oxochromene-3-carboxamide is sourced from PubChem (CID 47020558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).