1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine

C15H14N4 — CID 43769368

IUPAC1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine
SMILESc1ccc2nc(CNCc3ccncc3)cnc2c1
InChIInChI=1S/C15H14N4/c1-2-4-15-14(3-1)18-11-13(19-15)10-17-9-12-5-7-16-8-6-12/h1-8,11,17H,9-10H2
InChIKeyDYWHOLWKPPMCGF-UHFFFAOYSA-N
MW250.31 g/mol
LogP2.31
Rot. Bonds4

About 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine

1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine (PubChem CID 43769368) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine
PubChem CID43769368
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC Name1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine
SMILESc1ccc2nc(CNCc3ccncc3)cnc2c1
InChIInChI=1S/C15H14N4/c1-2-4-15-14(3-1)18-11-13(19-15)10-17-9-12-5-7-16-8-6-12/h1-8,11,17H,9-10H2
InChIKeyDYWHOLWKPPMCGF-UHFFFAOYSA-N
XLogP2.31
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(quinoxalin-2-ylmethyl)-1-thiophen-2-ylmethanamine
CID 43769302
2-pyridin-3-yl-N-(quinoxalin-2-ylmethyl)ethanamine
CID 60914777
2,2,3,3-tetrafluoro-N-(quinoxalin-2-ylmethyl)propan-1-amine
CID 106290130
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-quinoxalin-2-ylmethanamine
CID 78922105
2-ethoxy-N-(quinoxalin-2-ylmethyl)ethanamine
CID 43778393
3-methoxy-N-(quinoxalin-2-ylmethyl)propan-1-amine
CID 43769565
N-[(1-methylcyclopentyl)methyl]-1-quinoxalin-2-ylmethanamine
CID 63821652
2-cyclopropyl-N-(quinoxalin-2-ylmethyl)propan-1-amine
CID 113230822
N-[(2-pyridin-4-yl-1,3-thiazol-4-yl)methyl]quinoxalin-2-amine
CID 108780009
2-(quinoxalin-2-ylmethylamino)ethyl carbamate
CID 83211992
2-morpholin-4-yl-N-(quinoxalin-2-ylmethyl)ethanamine
CID 43764194
2-prop-2-enylsulfanyl-N-(quinoxalin-2-ylmethyl)ethanamine
CID 114187277

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine?
The IUPAC name of 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine (CID 43769368) is 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine.
What is the SMILES notation for 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine?
The canonical SMILES for 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine is c1ccc2nc(CNCc3ccncc3)cnc2c1.
What is the InChIKey of 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine?
The InChIKey is DYWHOLWKPPMCGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-2-4-15-14(3-1)18-11-13(19-15)10-17-9-12-5-7-16-8-6-12/h1-8,11,17H,9-10H2.
What are the key properties of 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine?
1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine has a molecular weight of 250.31 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-4-yl-N-(quinoxalin-2-ylmethyl)methanamine is sourced from PubChem (CID 43769368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).