N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide

C18H20N4O2 — CID 7937167

IUPACN-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide
SMILESC/C(=N/NC(=O)c1ccccn1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C18H20N4O2/c1-14(20-21-18(23)17-4-2-3-9-19-17)15-5-7-16(8-6-15)22-10-12-24-13-11-22/h2-9H,10-13H2,1H3,(H,21,23)/b20-14-
InChIKeyNGOBUXRTPNXSPJ-ZHZULCJRSA-N
MW324.38 g/mol
LogP2.07
Rot. Bonds4

About N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide

N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide (PubChem CID 7937167) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide
PubChem CID7937167
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC NameN-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide
SMILESC/C(=N/NC(=O)c1ccccn1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C18H20N4O2/c1-14(20-21-18(23)17-4-2-3-9-19-17)15-5-7-16(8-6-15)22-10-12-24-13-11-22/h2-9H,10-13H2,1H3,(H,21,23)/b20-14-
InChIKeyNGOBUXRTPNXSPJ-ZHZULCJRSA-N
XLogP2.07
TPSA66.82 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide?
The IUPAC name of N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide (CID 7937167) is N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide.
What is the SMILES notation for N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide?
The canonical SMILES for N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide is C/C(=N/NC(=O)c1ccccn1)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide?
The InChIKey is NGOBUXRTPNXSPJ-ZHZULCJRSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-14(20-21-18(23)17-4-2-3-9-19-17)15-5-7-16(8-6-15)22-10-12-24-13-11-22/h2-9H,10-13H2,1H3,(H,21,23)/b20-14-.
What are the key properties of N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide?
N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]pyridine-2-carboxamide is sourced from PubChem (CID 7937167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).