[4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine

C16H19N3O — CID 83188819

IUPAC[4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine
SMILESCc1nc(OC2CCCc3ccccc32)ncc1CN
InChIInChI=1S/C16H19N3O/c1-11-13(9-17)10-18-16(19-11)20-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,10,15H,4,6,8-9,17H2,1H3
InChIKeyLINQJMGMXCUMIG-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.70
Rot. Bonds3

About [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine

[4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine (PubChem CID 83188819) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine
PubChem CID83188819
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name[4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine
SMILESCc1nc(OC2CCCc3ccccc32)ncc1CN
InChIInChI=1S/C16H19N3O/c1-11-13(9-17)10-18-16(19-11)20-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,10,15H,4,6,8-9,17H2,1H3
InChIKeyLINQJMGMXCUMIG-UHFFFAOYSA-N
XLogP2.70
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine 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

2,4-dichloro-6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)-1,3,5-triazine
CID 62859248
[4-methyl-2-(2-methylcyclohexyl)oxypyrimidin-5-yl]methanamine
CID 83189352
[5-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)furan-2-yl]methanamine
CID 62457498
[2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine
CID 83189535
4-methyl-6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-2-amine
CID 80859900
6-bromo-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-4-amine
CID 116797621
6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrazin-2-amine
CID 80646899
2-tert-butyl-6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridine
CID 164708968
2-[2-amino-5-(1,2,3,4-tetrahydronaphthalen-1-yloxy)phenyl]acetonitrile
CID 102624855
5-bromo-4-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridin-3-amine
CID 103518708
3,5-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)pyridin-4-amine
CID 103183059
N'-hydroxy-5-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyridine-2-carboximidamide
CID 136990779

Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine?
The IUPAC name of [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine (CID 83188819) is [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine.
What is the SMILES notation for [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine?
The canonical SMILES for [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine is Cc1nc(OC2CCCc3ccccc32)ncc1CN.
What is the InChIKey of [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine?
The InChIKey is LINQJMGMXCUMIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-11-13(9-17)10-18-16(19-11)20-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,10,15H,4,6,8-9,17H2,1H3.
What are the key properties of [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine?
[4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine has a molecular weight of 269.35 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pyrimidin-5-yl]methanamine is sourced from PubChem (CID 83188819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).