N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine

C9H12N2 — CID 142610386

IUPACN-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine
SMILESC=C1NC=CC(C)=C1/N=C/C
InChIInChI=1S/C9H12N2/c1-4-10-9-7(2)5-6-11-8(9)3/h4-6,11H,3H2,1-2H3/b10-4+
InChIKeyNBXPFWMFLJNHHM-ONNFQVAWSA-N
MW148.21 g/mol
LogP1.98
Rot. Bonds1

About N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine

N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine (PubChem CID 142610386) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine.

Molecular Properties

Compound NameN-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine
PubChem CID142610386
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC NameN-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine
SMILESC=C1NC=CC(C)=C1/N=C/C
InChIInChI=1S/C9H12N2/c1-4-10-9-7(2)5-6-11-8(9)3/h4-6,11H,3H2,1-2H3/b10-4+
InChIKeyNBXPFWMFLJNHHM-ONNFQVAWSA-N
XLogP1.98
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Pyrido[3,2-c]azepine
CID 129706333
6-(ethylideneamino)-N-methylcyclohexa-1,5-dien-1-amine
CID 68274131
N-[(3E,5Z,8Z)-7,7-dimethyl-1,2-dihydroazonin-3-yl]ethanimine
CID 129126581
N-[(Z)-2-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethenyl]methanimine
CID 129144956
(E)-4-[(2E,4Z)-hepta-2,4,6-trien-2-yl]imino-N,2-dimethylbut-1-en-1-amine
CID 129215300
(3E)-4-N-ethenyl-5-(ethylideneamino)-3-methylpenta-1,3-diene-2,4-diamine
CID 130338658
(1Z,3E)-4-(ethylideneamino)-3-methylpenta-1,3-diene-1,5-diamine
CID 130350695
(2E)-N-ethenyl-2-ethylidenepyrrol-3-amine
CID 134292837
8H-pyrido[2,3-c]azepine
CID 141369396
(2E,3Z)-2,3-di(ethylidene)pyridine;(1Z)-N-methylbuta-1,3-dien-1-amine
CID 141819366
(2Z)-2-(ethylideneamino)-N-methylpenta-2,4-dien-1-amine
CID 142123452
N-[(1E)-1-(3-methylidene-1H-pyrrol-2-ylidene)propyl]ethanimine
CID 142160173

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine?
The IUPAC name of N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine (CID 142610386) is N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine.
What is the SMILES notation for N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine?
The canonical SMILES for N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine is C=C1NC=CC(C)=C1/N=C/C.
What is the InChIKey of N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine?
The InChIKey is NBXPFWMFLJNHHM-ONNFQVAWSA-N. The full InChI is InChI=1S/C9H12N2/c1-4-10-9-7(2)5-6-11-8(9)3/h4-6,11H,3H2,1-2H3/b10-4+.
What are the key properties of N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine?
N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine has a molecular weight of 148.21 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-methylidene-1H-pyridin-3-yl)ethanimine is sourced from PubChem (CID 142610386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).