(Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine

C9H11N3 — CID 144731406

IUPAC(Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine
SMILESC=NN/C(=C\C)c1ccccn1
InChIInChI=1S/C9H11N3/c1-3-8(12-10-2)9-6-4-5-7-11-9/h3-7,12H,2H2,1H3/b8-3-
InChIKeyJTVXWHQQECSVFK-BAQGIRSFSA-N
MW161.21 g/mol
LogP1.65
Rot. Bonds3

About (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine

(Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine (PubChem CID 144731406) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine
PubChem CID144731406
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name(Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine
SMILESC=NN/C(=C\C)c1ccccn1
InChIInChI=1S/C9H11N3/c1-3-8(12-10-2)9-6-4-5-7-11-9/h3-7,12H,2H2,1H3/b8-3-
InChIKeyJTVXWHQQECSVFK-BAQGIRSFSA-N
XLogP1.65
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.65
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'-amino-N-(methylideneamino)pyridine-2-carboximidamide
CID 89392630
(Z,Z)-N-(methylideneamino)-2-pyridin-2-ylbut-2-en-1-imine
CID 155726107
2-[(3Z)-penta-1,3-dien-3-yl]pyridine
CID 147592446
(E)-1-pyridin-2-ylprop-1-en-1-amine
CID 55290780
1-pyridin-2-ylethenylhydrazine
CID 170235415
N-[4-methyl-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 4867706
2-(3-methylbuta-1,3-dien-2-yl)pyridine
CID 91495924
N-methyl-1-pyridin-2-ylethanimine
CID 12970828
N-[(2,4-dimethylphenyl)-pyridin-2-ylmethylidene]hydroxylamine
CID 137247686
N,N'-bis(1-pyridin-2-ylethylideneamino)pentanediamide
CID 4258546
N-(dimethylaminomethylideneamino)pyridine-2-carboxamide
CID 174940489
ethane;(Z)-N-[(Z)-prop-1-enyl]-1-pyridin-2-ylbut-2-en-1-imine
CID 142201812

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine?
The IUPAC name of (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine (CID 144731406) is (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine.
What is the SMILES notation for (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine?
The canonical SMILES for (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine is C=NN/C(=C\C)c1ccccn1.
What is the InChIKey of (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine?
The InChIKey is JTVXWHQQECSVFK-BAQGIRSFSA-N. The full InChI is InChI=1S/C9H11N3/c1-3-8(12-10-2)9-6-4-5-7-11-9/h3-7,12H,2H2,1H3/b8-3-.
What are the key properties of (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine?
(Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine has a molecular weight of 161.21 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(methylideneamino)-1-pyridin-2-ylprop-1-en-1-amine is sourced from PubChem (CID 144731406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).