N-[(E)-but-2-enyl]-2-methylpyridin-4-amine

C10H14N2 — CID 131243959

IUPACN-[(E)-but-2-enyl]-2-methylpyridin-4-amine
SMILESC/C=C/CNc1ccnc(C)c1
InChIInChI=1S/C10H14N2/c1-3-4-6-12-10-5-7-11-9(2)8-10/h3-5,7-8H,6H2,1-2H3,(H,11,12)/b4-3+
InChIKeyCYTXFJNOWAWJPC-ONEGZZNKSA-N
MW162.24 g/mol
LogP2.38
Rot. Bonds3

About N-[(E)-but-2-enyl]-2-methylpyridin-4-amine

N-[(E)-but-2-enyl]-2-methylpyridin-4-amine (PubChem CID 131243959) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-[(E)-but-2-enyl]-2-methylpyridin-4-amine.

Molecular Properties

Compound NameN-[(E)-but-2-enyl]-2-methylpyridin-4-amine
PubChem CID131243959
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-[(E)-but-2-enyl]-2-methylpyridin-4-amine
SMILESC/C=C/CNc1ccnc(C)c1
InChIInChI=1S/C10H14N2/c1-3-4-6-12-10-5-7-11-9(2)8-10/h3-5,7-8H,6H2,1-2H3,(H,11,12)/b4-3+
InChIKeyCYTXFJNOWAWJPC-ONEGZZNKSA-N
XLogP2.38
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(E)-but-2-enyl]-2-methylpyridin-4-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

2-methyl-N-propylpyridin-4-amine
CID 79240818
2,2-dimethyl-N-(2-methyl-4-pyridinyl)butane-1,4-diamine
CID 106142118
N-[2-(3,5-difluorophenyl)ethyl]-2-methylpyridin-4-amine
CID 113482614
2-methyl-N-[2-(trifluoromethylsulfanyl)ethyl]pyridin-4-amine
CID 103512470
4-hydroxy-N-(2-methyl-4-pyridinyl)butanamide
CID 79240902
N-[2-(chloromethyl)-2-ethylbutyl]-2-methylpyridin-4-amine
CID 106252961
N-[(E)-but-2-enyl]-4-chloroaniline
CID 10821279
2-N-[(E)-but-2-enyl]pyridine-2,3,4-triamine
CID 131241598
3-bromo-N-[(E)-but-2-enyl]-4-fluoroaniline
CID 107899240
N-(2-methyl-4-pyridinyl)-N',N'-di(propan-2-yl)propane-1,3-diamine
CID 133492181
N-(2-methyl-4-pyridinyl)butanamide
CID 78910950
azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide
CID 58492755

Frequently Asked Questions

What is the IUPAC name of N-[(E)-but-2-enyl]-2-methylpyridin-4-amine?
The IUPAC name of N-[(E)-but-2-enyl]-2-methylpyridin-4-amine (CID 131243959) is N-[(E)-but-2-enyl]-2-methylpyridin-4-amine.
What is the SMILES notation for N-[(E)-but-2-enyl]-2-methylpyridin-4-amine?
The canonical SMILES for N-[(E)-but-2-enyl]-2-methylpyridin-4-amine is C/C=C/CNc1ccnc(C)c1.
What is the InChIKey of N-[(E)-but-2-enyl]-2-methylpyridin-4-amine?
The InChIKey is CYTXFJNOWAWJPC-ONEGZZNKSA-N. The full InChI is InChI=1S/C10H14N2/c1-3-4-6-12-10-5-7-11-9(2)8-10/h3-5,7-8H,6H2,1-2H3,(H,11,12)/b4-3+.
What are the key properties of N-[(E)-but-2-enyl]-2-methylpyridin-4-amine?
N-[(E)-but-2-enyl]-2-methylpyridin-4-amine has a molecular weight of 162.24 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-but-2-enyl]-2-methylpyridin-4-amine is sourced from PubChem (CID 131243959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).