N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide

C15H15N3O2 — CID 40618803

IUPACN-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide
SMILESCCOc1cccc(/C=N\NC(=O)c2ccccn2)c1
InChIInChI=1S/C15H15N3O2/c1-2-20-13-7-5-6-12(10-13)11-17-18-15(19)14-8-3-4-9-16-14/h3-11H,2H2,1H3,(H,18,19)/b17-11-
InChIKeyJAYHERPHCRZIRZ-BOPFTXTBSA-N
MW269.30 g/mol
LogP2.24
Rot. Bonds5

About N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide

N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide (PubChem CID 40618803) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide
PubChem CID40618803
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide
SMILESCCOc1cccc(/C=N\NC(=O)c2ccccn2)c1
InChIInChI=1S/C15H15N3O2/c1-2-20-13-7-5-6-12(10-13)11-17-18-15(19)14-8-3-4-9-16-14/h3-11H,2H2,1H3,(H,18,19)/b17-11-
InChIKeyJAYHERPHCRZIRZ-BOPFTXTBSA-N
XLogP2.24
TPSA63.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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Related Compounds

N-[(E)-(3-ethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 44613929
N-[(3-methoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 761649
N-[(3-phenylmethoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 950938
N-[(Z)-[3-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]pyridine-2-carboxamide
CID 9194640
N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 6887460
N-[(E)-pyridin-3-ylmethylideneamino]pyridine-2-carboxamide
CID 6870358
4-ethoxy-N-[(E)-(3-propoxyphenyl)methylideneamino]benzamide
CID 17246375
N-[(Z)-[4-[2-(dimethylamino)-2-oxoethoxy]-3-ethoxyphenyl]methylideneamino]pyridine-2-carboxamide
CID 9015583
N-[(4-ethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 760521
ethyl 2-[3-[(E)-[(4-ethoxybenzoyl)hydrazinylidene]methyl]phenoxy]acetate
CID 17246379
N-(2-chlorophenyl)-N'-[(3-ethoxyphenyl)methylideneamino]butanediamide
CID 4022136
N-[(3-chloro-4-methoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 871932

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide?
The IUPAC name of N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide (CID 40618803) is N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide.
What is the SMILES notation for N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide?
The canonical SMILES for N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide is CCOc1cccc(/C=N\NC(=O)c2ccccn2)c1.
What is the InChIKey of N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide?
The InChIKey is JAYHERPHCRZIRZ-BOPFTXTBSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-2-20-13-7-5-6-12(10-13)11-17-18-15(19)14-8-3-4-9-16-14/h3-11H,2H2,1H3,(H,18,19)/b17-11-.
What are the key properties of N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide?
N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide is sourced from PubChem (CID 40618803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).