N-[(Z)-propylideneamino]pyridine-4-carboxamide

C9H11N3O — CID 6119038

IUPACN-[(Z)-propylideneamino]pyridine-4-carboxamide
SMILESCC/C=N\NC(=O)c1ccncc1
InChIInChI=1S/C9H11N3O/c1-2-5-11-12-9(13)8-3-6-10-7-4-8/h3-7H,2H2,1H3,(H,12,13)/b11-5-
InChIKeySNCFHIZNEFTJRP-WZUFQYTHSA-N
MW177.21 g/mol
LogP1.21
Rot. Bonds3

About N-[(Z)-propylideneamino]pyridine-4-carboxamide

N-[(Z)-propylideneamino]pyridine-4-carboxamide (PubChem CID 6119038) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is N-[(Z)-propylideneamino]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(Z)-propylideneamino]pyridine-4-carboxamide
PubChem CID6119038
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC NameN-[(Z)-propylideneamino]pyridine-4-carboxamide
SMILESCC/C=N\NC(=O)c1ccncc1
InChIInChI=1S/C9H11N3O/c1-2-5-11-12-9(13)8-3-6-10-7-4-8/h3-7H,2H2,1H3,(H,12,13)/b11-5-
InChIKeySNCFHIZNEFTJRP-WZUFQYTHSA-N
XLogP1.21
TPSA54.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.21
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'}

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Related Compounds

N-[(E)-3-aminopropylideneamino]pyridine-4-carboxamide
CID 58684890
N-[[4-[(pyridine-4-carbonylhydrazinylidene)methyl]phenyl]methylideneamino]pyridine-4-carboxamide
CID 1101714
N-(prop-2-enylideneamino)pyridine-4-carboxamide
CID 141269925
N-[(2-ethoxyphenyl)methylideneamino]pyridine-4-carboxamide
CID 690991
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]pyridine-4-carboxamide;hydrate
CID 21230438
N-[(Z)-pentan-2-ylideneamino]pyridine-4-carboxamide
CID 6114549
N-[(2-methylphenyl)methylideneamino]pyridine-4-carboxamide
CID 690992
N-[(E)-1-pyridin-4-ylethylideneamino]pyridine-4-carboxamide
CID 5402716
N-[(E)-(2,4-difluorophenyl)methylideneamino]pyridine-4-carboxamide
CID 6902849
N-[(E)-(4-bromophenyl)methylideneamino]pyridine-4-carboxamide
CID 5332577
N-(2-methylpentan-3-ylideneamino)pyridine-4-carboxamide
CID 84902461
N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide
CID 5149584

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-propylideneamino]pyridine-4-carboxamide?
The IUPAC name of N-[(Z)-propylideneamino]pyridine-4-carboxamide (CID 6119038) is N-[(Z)-propylideneamino]pyridine-4-carboxamide.
What is the SMILES notation for N-[(Z)-propylideneamino]pyridine-4-carboxamide?
The canonical SMILES for N-[(Z)-propylideneamino]pyridine-4-carboxamide is CC/C=N\NC(=O)c1ccncc1.
What is the InChIKey of N-[(Z)-propylideneamino]pyridine-4-carboxamide?
The InChIKey is SNCFHIZNEFTJRP-WZUFQYTHSA-N. The full InChI is InChI=1S/C9H11N3O/c1-2-5-11-12-9(13)8-3-6-10-7-4-8/h3-7H,2H2,1H3,(H,12,13)/b11-5-.
What are the key properties of N-[(Z)-propylideneamino]pyridine-4-carboxamide?
N-[(Z)-propylideneamino]pyridine-4-carboxamide has a molecular weight of 177.21 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-propylideneamino]pyridine-4-carboxamide is sourced from PubChem (CID 6119038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).