6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide

C19H19N3O — CID 3645060

IUPAC6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide
SMILESCC(C=CC=Cc1ccccc1)=NNC(=O)c1ccc(C)nc1
InChIInChI=1S/C19H19N3O/c1-15-12-13-18(14-20-15)19(23)22-21-16(2)8-6-7-11-17-9-4-3-5-10-17/h3-14H,1-2H3,(H,22,23)
InChIKeyYRJNNSGKDJFYCD-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.77
Rot. Bonds5

About 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide

6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide (PubChem CID 3645060) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide
PubChem CID3645060
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide
SMILESCC(C=CC=Cc1ccccc1)=NNC(=O)c1ccc(C)nc1
InChIInChI=1S/C19H19N3O/c1-15-12-13-18(14-20-15)19(23)22-21-16(2)8-6-7-11-17-9-4-3-5-10-17/h3-14H,1-2H3,(H,22,23)
InChIKeyYRJNNSGKDJFYCD-UHFFFAOYSA-N
XLogP3.77
TPSA54.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-benzylideneamino]-6-methylpyridine-3-carboxamide
CID 5370943
N-[[(E)-4-phenylbut-3-en-2-ylidene]amino]benzamide
CID 724511
N-[4-(1,3-benzodioxol-5-yl)but-3-en-2-ylideneamino]-6-methylpyridine-3-carboxamide
CID 949999
2-chloro-4-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)benzamide
CID 71952028
4-bromo-N-[(E)-[(E)-4-phenylbut-3-en-2-ylidene]amino]benzamide
CID 6948702
4-bromo-N-(4-phenylbut-3-en-2-ylideneamino)benzamide
CID 834129
6-methyl-N-[[3-(3-nitrophenyl)-1-phenylprop-2-enylidene]amino]pyridine-3-carboxamide
CID 4996641
4-methoxy-N-[(E)-[(E)-4-phenylbut-3-en-2-ylidene]amino]benzamide
CID 7348333
6-methyl-N-[(E)-1-(4-methylphenyl)ethylideneamino]pyridine-3-carboxamide
CID 45100248
2-(2-cyanophenoxy)-N-[(Z)-[(3E,5E)-6-phenylhexa-3,5-dien-2-ylidene]amino]acetamide
CID 6261617
2-(2-chlorophenoxy)-N-[(E)-[(3E,5E)-6-phenylhexa-3,5-dien-2-ylidene]amino]acetamide
CID 7325198
(2Z,4E)-1-(4-methylphenyl)-5-phenylpenta-2,4-dien-1-one
CID 54612350

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide (CID 3645060) is 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide is CC(C=CC=Cc1ccccc1)=NNC(=O)c1ccc(C)nc1.
What is the InChIKey of 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide?
The InChIKey is YRJNNSGKDJFYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-15-12-13-18(14-20-15)19(23)22-21-16(2)8-6-7-11-17-9-4-3-5-10-17/h3-14H,1-2H3,(H,22,23).
What are the key properties of 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide?
6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(6-phenylhexa-3,5-dien-2-ylideneamino)pyridine-3-carboxamide is sourced from PubChem (CID 3645060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).