3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine

C15H14N4 — CID 60734444

IUPAC3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine
SMILESCc1nc2ccccc2nc1NCc1ccncc1
InChIInChI=1S/C15H14N4/c1-11-15(17-10-12-6-8-16-9-7-12)19-14-5-3-2-4-13(14)18-11/h2-9H,10H2,1H3,(H,17,19)
InChIKeyJHCDKQUBPWFRBP-UHFFFAOYSA-N
MW250.31 g/mol
LogP2.95
Rot. Bonds3

About 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine

3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine (PubChem CID 60734444) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine.

Molecular Properties

Compound Name3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine
PubChem CID60734444
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC Name3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine
SMILESCc1nc2ccccc2nc1NCc1ccncc1
InChIInChI=1S/C15H14N4/c1-11-15(17-10-12-6-8-16-9-7-12)19-14-5-3-2-4-13(14)18-11/h2-9H,10H2,1H3,(H,17,19)
InChIKeyJHCDKQUBPWFRBP-UHFFFAOYSA-N
XLogP2.95
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-ethylphenyl)methyl]-3-methylquinoxalin-2-amine
CID 106900035
N-methyl-N-[4-[[(3-methylquinoxalin-2-yl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 133305360
3-methyl-N-(thiophen-2-ylmethyl)quinoxalin-2-amine
CID 36590033
3-methyl-N-(1,2-oxazol-5-ylmethyl)quinoxalin-2-amine
CID 106419114
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-methylquinoxalin-2-amine
CID 133306015
N-[(2-bromophenyl)methyl]-3-methylquinoxalin-2-amine
CID 62049687
N-[(3-chloro-4-fluorophenyl)methyl]-3-methylquinoxalin-2-amine
CID 62537479
3-methyl-N-(pyridin-4-ylmethyl)pyrazin-2-amine
CID 83063577
3-methyl-N-[(3-methylthiophen-2-yl)methyl]quinoxalin-2-amine
CID 34013980
3-methyl-N-prop-2-enylquinoxalin-2-amine
CID 60734557
3-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]quinoxalin-2-amine
CID 79033643
3-methyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]quinoxalin-2-amine
CID 108774975

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine?
The IUPAC name of 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine (CID 60734444) is 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine.
What is the SMILES notation for 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine?
The canonical SMILES for 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine is Cc1nc2ccccc2nc1NCc1ccncc1.
What is the InChIKey of 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine?
The InChIKey is JHCDKQUBPWFRBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-11-15(17-10-12-6-8-16-9-7-12)19-14-5-3-2-4-13(14)18-11/h2-9H,10H2,1H3,(H,17,19).
What are the key properties of 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine?
3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine has a molecular weight of 250.31 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(pyridin-4-ylmethyl)quinoxalin-2-amine is sourced from PubChem (CID 60734444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).