2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine

C19H20N4O2 — CID 53317523

IUPAC2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine
SMILESCOc1cccc(-c2cc(NCCc3cccnc3)nc(OC)n2)c1
InChIInChI=1S/C19H20N4O2/c1-24-16-7-3-6-15(11-16)17-12-18(23-19(22-17)25-2)21-10-8-14-5-4-9-20-13-14/h3-7,9,11-13H,8,10H2,1-2H3,(H,21,22,23)
InChIKeyOMHGGYUHFYFPEC-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.21
Rot. Bonds7

About 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine

2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine (PubChem CID 53317523) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine
PubChem CID53317523
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine
SMILESCOc1cccc(-c2cc(NCCc3cccnc3)nc(OC)n2)c1
InChIInChI=1S/C19H20N4O2/c1-24-16-7-3-6-15(11-16)17-12-18(23-19(22-17)25-2)21-10-8-14-5-4-9-20-13-14/h3-7,9,11-13H,8,10H2,1-2H3,(H,21,22,23)
InChIKeyOMHGGYUHFYFPEC-UHFFFAOYSA-N
XLogP3.21
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine?
The IUPAC name of 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine (CID 53317523) is 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine?
The canonical SMILES for 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine is COc1cccc(-c2cc(NCCc3cccnc3)nc(OC)n2)c1.
What is the InChIKey of 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine?
The InChIKey is OMHGGYUHFYFPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-24-16-7-3-6-15(11-16)17-12-18(23-19(22-17)25-2)21-10-8-14-5-4-9-20-13-14/h3-7,9,11-13H,8,10H2,1-2H3,(H,21,22,23).
What are the key properties of 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine?
2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine has a molecular weight of 336.40 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(3-methoxyphenyl)-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine is sourced from PubChem (CID 53317523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).