2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine

C14H18N4O — CID 62744312

IUPAC2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine
SMILESCOCCNCc1cc(C)nc(-c2ccccn2)n1
InChIInChI=1S/C14H18N4O/c1-11-9-12(10-15-7-8-19-2)18-14(17-11)13-5-3-4-6-16-13/h3-6,9,15H,7-8,10H2,1-2H3
InChIKeyUBDQZBBHVNSNAM-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.58
Rot. Bonds6

About 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine

2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine (PubChem CID 62744312) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine
PubChem CID62744312
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine
SMILESCOCCNCc1cc(C)nc(-c2ccccn2)n1
InChIInChI=1S/C14H18N4O/c1-11-9-12(10-15-7-8-19-2)18-14(17-11)13-5-3-4-6-16-13/h3-6,9,15H,7-8,10H2,1-2H3
InChIKeyUBDQZBBHVNSNAM-UHFFFAOYSA-N
XLogP1.58
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[[2-(4-fluorophenyl)-6-methylpyrimidin-4-yl]methyl]-2-methoxyethanamine
CID 62746066
(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methanol
CID 62743365
2-methoxy-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 43234329
2-methoxy-N-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)methyl]ethanamine
CID 62745007
N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine
CID 55114618
N-[(6-methyl-2-phenylpyrimidin-4-yl)methyl]propan-1-amine
CID 62745336
5-[(2-methoxyethylamino)methyl]-N,4-dimethyl-N-(pyridin-2-ylmethyl)-1,3-thiazol-2-amine
CID 62769379
N-[(4-tert-butyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methyl]-2-methoxyethanamine
CID 82438601
N-[[2-(2-chlorophenyl)pyrimidin-4-yl]methyl]-2-methoxyethanamine
CID 62748837
2-[(2-methoxyethylamino)methyl]pyridin-3-amine
CID 104740028
4-chloro-6-(methoxymethyl)-2-pyridin-2-ylpyrimidine
CID 62319942
4-methyl-2-pyridin-2-yl-6-[(2,3,5-trifluorophenoxy)methyl]pyrimidine
CID 127040097

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine (CID 62744312) is 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine is COCCNCc1cc(C)nc(-c2ccccn2)n1.
What is the InChIKey of 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine?
The InChIKey is UBDQZBBHVNSNAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-11-9-12(10-15-7-8-19-2)18-14(17-11)13-5-3-4-6-16-13/h3-6,9,15H,7-8,10H2,1-2H3.
What are the key properties of 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine?
2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine has a molecular weight of 258.32 g/mol, XLogP of 1.58, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine is sourced from PubChem (CID 62744312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).