5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine

C15H13N3O — CID 122237679

IUPAC5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine
SMILESCOc1ccc2cc(-c3cnc(N)nc3)ccc2c1
InChIInChI=1S/C15H13N3O/c1-19-14-5-4-10-6-11(2-3-12(10)7-14)13-8-17-15(16)18-9-13/h2-9H,1H3,(H2,16,17,18)
InChIKeyICNGWUPMFCXSSQ-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.89
Rot. Bonds2

About 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine

5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine (PubChem CID 122237679) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine
PubChem CID122237679
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine
SMILESCOc1ccc2cc(-c3cnc(N)nc3)ccc2c1
InChIInChI=1S/C15H13N3O/c1-19-14-5-4-10-6-11(2-3-12(10)7-14)13-8-17-15(16)18-9-13/h2-9H,1H3,(H2,16,17,18)
InChIKeyICNGWUPMFCXSSQ-UHFFFAOYSA-N
XLogP2.89
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-6-(4-methoxyphenyl)naphthalene
CID 11149734
5-naphthalen-2-ylpyrimidin-2-amine
CID 139194225
5-(3-fluoro-4-methoxyphenyl)pyrimidin-2-amine
CID 57445392
2-methoxy-6-[6-[6-(6-methylnaphthalen-2-yl)naphthalen-2-yl]naphthalen-2-yl]naphthalene
CID 58556071
2-methoxy-6-phenylnaphthalene
CID 11253308
5-(6-methoxy-1,3-benzothiazol-2-yl)pyrimidin-2-amine
CID 24804069
2-(4-chlorophenyl)-6-methoxynaphthalene
CID 45156517
2-(3-fluorophenyl)-6-methoxynaphthalene
CID 45156519
2-methoxynaphthalene;2-phenylnaphthalene
CID 173269029
2-methoxy-6-(3-methoxy-4-methylphenyl)naphthalene
CID 57012474
5-(6-methoxynaphthalen-2-yl)-6-methylpyridin-2-amine
CID 79048610
2-(4-chlorophenyl)-7-methoxynaphthalene
CID 54239176

Frequently Asked Questions

What is the IUPAC name of 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine?
The IUPAC name of 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine (CID 122237679) is 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine.
What is the SMILES notation for 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine?
The canonical SMILES for 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine is COc1ccc2cc(-c3cnc(N)nc3)ccc2c1.
What is the InChIKey of 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine?
The InChIKey is ICNGWUPMFCXSSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-19-14-5-4-10-6-11(2-3-12(10)7-14)13-8-17-15(16)18-9-13/h2-9H,1H3,(H2,16,17,18).
What are the key properties of 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine?
5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine has a molecular weight of 251.29 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methoxynaphthalen-2-yl)pyrimidin-2-amine is sourced from PubChem (CID 122237679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).