(Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine

C9H11N3 — CID 166120557

IUPAC(Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine
SMILES[H]/N=C/C=C(\N)c1ccc(C)cn1
InChIInChI=1S/C9H11N3/c1-7-2-3-9(12-6-7)8(11)4-5-10/h2-6,10H,11H2,1H3/b8-4-,10-5+
InChIKeyOOWKMZSBGKUTGK-HZEUFOEUSA-N
MW161.21 g/mol
LogP1.34
Rot. Bonds2

About (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine

(Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine (PubChem CID 166120557) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine
PubChem CID166120557
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name(Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine
SMILES[H]/N=C/C=C(\N)c1ccc(C)cn1
InChIInChI=1S/C9H11N3/c1-7-2-3-9(12-6-7)8(11)4-5-10/h2-6,10H,11H2,1H3/b8-4-,10-5+
InChIKeyOOWKMZSBGKUTGK-HZEUFOEUSA-N
XLogP1.34
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine
CID 174335026
5-methylpyridine-2-carboximidoyl iodide
CID 177223658
(Z)-1-(2,6-dimethylphenyl)-3-iminoprop-1-en-1-amine
CID 163243515
3-imino-1-(3-methylphenyl)prop-1-en-1-amine
CID 148702605
(Z)-3-imino-1-(3-methylphenyl)prop-1-en-1-amine
CID 145049021
N'-amino-5-methylpyridine-2-carboximidamide
CID 81312548
ethane;2-[(3E)-hexa-1,3,5-trien-3-yl]-5-methylpyridine
CID 142353727
(Z)-1-(3,4-dimethylphenyl)-3-iminoprop-1-en-1-amine
CID 168944442
ethane;(Z)-2-hydrazinyl-2-(5-methyl-2-pyridinyl)ethenamine
CID 171527313
1-(4-chlorophenyl)-3-iminoprop-1-en-1-amine
CID 173297669
(Z)-1-[2-(1-ethynylcyclopropyl)-5-methylphenyl]-3-iminoprop-1-en-1-amine
CID 176940262
N-ethenyl-2-(5-methyl-2-pyridinyl)prop-2-en-1-imine
CID 144518543

Frequently Asked Questions

What is the IUPAC name of (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine?
The IUPAC name of (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine (CID 166120557) is (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine.
What is the SMILES notation for (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine?
The canonical SMILES for (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine is [H]/N=C/C=C(\N)c1ccc(C)cn1.
What is the InChIKey of (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine?
The InChIKey is OOWKMZSBGKUTGK-HZEUFOEUSA-N. The full InChI is InChI=1S/C9H11N3/c1-7-2-3-9(12-6-7)8(11)4-5-10/h2-6,10H,11H2,1H3/b8-4-,10-5+.
What are the key properties of (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine?
(Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine has a molecular weight of 161.21 g/mol, XLogP of 1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-imino-1-(5-methyl-2-pyridinyl)prop-1-en-1-amine is sourced from PubChem (CID 166120557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).