4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine

C16H15N3O — CID 116900581

IUPAC4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine
SMILESCNc1nccc(-c2ccc3cc(OC)ccc3c2)n1
InChIInChI=1S/C16H15N3O/c1-17-16-18-8-7-15(19-16)13-4-3-12-10-14(20-2)6-5-11(12)9-13/h3-10H,1-2H3,(H,17,18,19)
InChIKeyKPOHLBXRNNOYLS-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.35
Rot. Bonds3

About 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine

4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine (PubChem CID 116900581) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine
PubChem CID116900581
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine
SMILESCNc1nccc(-c2ccc3cc(OC)ccc3c2)n1
InChIInChI=1S/C16H15N3O/c1-17-16-18-8-7-15(19-16)13-4-3-12-10-14(20-2)6-5-11(12)9-13/h3-10H,1-2H3,(H,17,18,19)
InChIKeyKPOHLBXRNNOYLS-UHFFFAOYSA-N
XLogP3.35
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(6-methoxynaphthalen-2-yl)-N-methylpyrazin-2-amine
CID 115914330
4-[4-(difluoromethoxy)phenyl]-N-methylpyrimidin-2-amine
CID 63549274
4-(3-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]pyrimidin-2-amine
CID 71655715
N-(2-hydroxyethyl)-2-[[7-methoxy-3-[2-(methylamino)pyrimidin-4-yl]naphthalen-1-yl]amino]acetamide
CID 53257948
N-methyl-4-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrimidin-2-amine
CID 116900518
2-methoxy-4-(6-methylnaphthalen-2-yl)pyrimidine
CID 116903843
2-methoxy-6-(4-methoxyphenyl)naphthalene
CID 11149734
4-(6-methoxyquinolin-2-yl)-N-methylaniline
CID 46931568
N-[(3,4-dichlorophenyl)methyl]-4-(4-methoxyphenyl)pyrimidin-2-amine
CID 46172980
2-[(3-hydroxy-2,2-dimethylpropyl)amino]-N-[7-methoxy-3-[2-(methylamino)pyrimidin-4-yl]naphthalen-1-yl]acetamide
CID 53258879
3-[[7-methoxy-3-[2-(methylamino)pyrimidin-4-yl]naphthalen-1-yl]amino]pyrrolidine-1-carboxylic acid
CID 123573558
4-[2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-methylpyrimidin-2-amine
CID 59607257

Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine?
The IUPAC name of 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine (CID 116900581) is 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine.
What is the SMILES notation for 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine?
The canonical SMILES for 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine is CNc1nccc(-c2ccc3cc(OC)ccc3c2)n1.
What is the InChIKey of 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine?
The InChIKey is KPOHLBXRNNOYLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-17-16-18-8-7-15(19-16)13-4-3-12-10-14(20-2)6-5-11(12)9-13/h3-10H,1-2H3,(H,17,18,19).
What are the key properties of 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine?
4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine has a molecular weight of 265.32 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-2-amine is sourced from PubChem (CID 116900581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).