4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine

C15H13N5O — CID 170970558

IUPAC4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine
SMILESCOc1cc(-c2ccnc(Nc3ccncc3)n2)ccn1
InChIInChI=1S/C15H13N5O/c1-21-14-10-11(2-8-17-14)13-5-9-18-15(20-13)19-12-3-6-16-7-4-12/h2-10H,1H3,(H,16,18,19,20)
InChIKeyIKAPXZBVKZFIAJ-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.69
Rot. Bonds4

About 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine

4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine (PubChem CID 170970558) has the molecular formula C15H13N5O and a molecular weight of 279.30 g/mol. Its IUPAC name is 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine
PubChem CID170970558
Molecular FormulaC15H13N5O
Molecular Weight279.30 g/mol
Exact Mass279.11
IUPAC Name4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine
SMILESCOc1cc(-c2ccnc(Nc3ccncc3)n2)ccn1
InChIInChI=1S/C15H13N5O/c1-21-14-10-11(2-8-17-14)13-5-9-18-15(20-13)19-12-3-6-16-7-4-12/h2-10H,1H3,(H,16,18,19,20)
InChIKeyIKAPXZBVKZFIAJ-UHFFFAOYSA-N
XLogP2.69
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-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

4-(2-methoxy-4-pyridinyl)-N-pyrimidin-2-ylpyrimidin-2-amine
CID 170970741
N-[3-(2-aminoethoxy)phenyl]-4-(2-methoxy-4-pyridinyl)pyrimidin-2-amine
CID 170970806
N-(2-methoxy-4-pyridinyl)-4-methylpyrimidin-2-amine
CID 66596222
4-N-(4-pyridin-4-ylpyrimidin-2-yl)benzene-1,4-diamine
CID 11715896
3-N,3-N-dimethyl-1-N-(4-pyridin-4-ylpyrimidin-2-yl)benzene-1,3-diamine
CID 14347136
N-(3-fluorophenyl)-4-(6-methoxy-3-pyridinyl)pyrimidin-2-amine
CID 170970463
4-[(4-pyridin-4-ylpyrimidin-2-yl)amino]benzamide
CID 69235477
N-(4-methoxyphenyl)-4-(1-methylpyridin-1-ium-4-yl)pyrimidin-2-amine iodide
CID 14722187
4-[2-[3-[[2-(3-methoxyanilino)-6-(2-methoxy-4-pyridinyl)pyrimidin-4-yl]methoxy]anilino]pyrimidin-4-yl]-1H-pyridin-2-one
CID 174198941
4-(2-butan-2-yloxy-4-pyridinyl)-N-(3-chlorophenyl)pyrimidin-2-amine
CID 16746118
N-(3-methoxyphenyl)-4-thiophen-3-ylpyrimidin-2-amine
CID 14347056
4-naphthalen-2-yl-N-phenylpyrimidin-2-amine
CID 66493679

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine?
The IUPAC name of 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine (CID 170970558) is 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine.
What is the SMILES notation for 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine?
The canonical SMILES for 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine is COc1cc(-c2ccnc(Nc3ccncc3)n2)ccn1.
What is the InChIKey of 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine?
The InChIKey is IKAPXZBVKZFIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O/c1-21-14-10-11(2-8-17-14)13-5-9-18-15(20-13)19-12-3-6-16-7-4-12/h2-10H,1H3,(H,16,18,19,20).
What are the key properties of 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine?
4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine has a molecular weight of 279.30 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-4-pyridinyl)-N-pyridin-4-ylpyrimidin-2-amine is sourced from PubChem (CID 170970558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).