N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine

C14H17N3 — CID 62322147

IUPACN-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine
SMILESCc1cccc(CNCCc2ccncc2)n1
InChIInChI=1S/C14H17N3/c1-12-3-2-4-14(17-12)11-16-10-7-13-5-8-15-9-6-13/h2-6,8-9,16H,7,10-11H2,1H3
InChIKeyDOONOWOIGJPOOO-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.12
Rot. Bonds5

About N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine

N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine (PubChem CID 62322147) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine.

Molecular Properties

Compound NameN-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine
PubChem CID62322147
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC NameN-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine
SMILESCc1cccc(CNCCc2ccncc2)n1
InChIInChI=1S/C14H17N3/c1-12-3-2-4-14(17-12)11-16-10-7-13-5-8-15-9-6-13/h2-6,8-9,16H,7,10-11H2,1H3
InChIKeyDOONOWOIGJPOOO-UHFFFAOYSA-N
XLogP2.12
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine 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-(3-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 79267953
1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 15491901
N'-[(6-methyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 14280569
2-(1-methylpyrazol-3-yl)-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 114143921
N-[(6-methyl-2-pyridinyl)methyl]-3-methylsulfanylpropan-1-amine
CID 60961143
1-(3-methyl-4-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 114699720
N-[(6-methyl-2-pyridinyl)methyl]-2-(1,2,4-oxadiazol-3-yl)ethanamine
CID 106400795
N-[(6-methyl-2-pyridinyl)methyl]-1-pyridin-2-ylmethanamine
CID 15900109
N-[[3-(aminomethyl)phenyl]methyl]-2-pyridin-4-ylethanamine
CID 115213067
N-[(4-ethylphenyl)methyl]-2-pyridin-4-ylethanamine
CID 54943545
2-pyridin-4-yl-N-(pyrimidin-2-ylmethyl)ethanamine
CID 62700658
3-[(6-methyl-2-pyridinyl)methylamino]propanamide
CID 62323562

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine?
The IUPAC name of N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine (CID 62322147) is N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine.
What is the SMILES notation for N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine?
The canonical SMILES for N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine is Cc1cccc(CNCCc2ccncc2)n1.
What is the InChIKey of N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine?
The InChIKey is DOONOWOIGJPOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-12-3-2-4-14(17-12)11-16-10-7-13-5-8-15-9-6-13/h2-6,8-9,16H,7,10-11H2,1H3.
What are the key properties of N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine?
N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine has a molecular weight of 227.31 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-4-ylethanamine is sourced from PubChem (CID 62322147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).