2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide

C16H18N4O2 — CID 119946355

IUPAC2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
SMILESNc1ccccc1C(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C16H18N4O2/c17-14-4-2-1-3-13(14)16(21)19-12-5-6-15(18-11-12)20-7-9-22-10-8-20/h1-6,11H,7-10,17H2,(H,19,21)
InChIKeyQFAHKIGEIXTOGX-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.75
Rot. Bonds3

About 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide

2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide (PubChem CID 119946355) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide.

Molecular Properties

Compound Name2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
PubChem CID119946355
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Name2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
SMILESNc1ccccc1C(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C16H18N4O2/c17-14-4-2-1-3-13(14)16(21)19-12-5-6-15(18-11-12)20-7-9-22-10-8-20/h1-6,11H,7-10,17H2,(H,19,21)
InChIKeyQFAHKIGEIXTOGX-UHFFFAOYSA-N
XLogP1.75
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 46553100
5-bromo-2-chloro-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 34442516
3-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide;dihydrochloride
CID 119839707
N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide
CID 3975213
2-methyl-N-(6-morpholin-4-yl-3-pyridinyl)quinoline-3-carboxamide
CID 86915804
2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide
CID 18158652
N-(3,4-diaminophenyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 86248826
2-bromo-N-[6-(4-formylpiperazin-1-yl)-3-pyridinyl]benzamide
CID 113011122
1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47162241
N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyltriazole-4-carboxamide
CID 46684120
1-benzyl-2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)pyrrole-3-carboxamide
CID 30771595
2,2-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 11391397

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The IUPAC name of 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide (CID 119946355) is 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide.
What is the SMILES notation for 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The canonical SMILES for 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide is Nc1ccccc1C(=O)Nc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The InChIKey is QFAHKIGEIXTOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c17-14-4-2-1-3-13(14)16(21)19-12-5-6-15(18-11-12)20-7-9-22-10-8-20/h1-6,11H,7-10,17H2,(H,19,21).
What are the key properties of 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide has a molecular weight of 298.35 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide is sourced from PubChem (CID 119946355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).