1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine

C15H25N3O — CID 64572331

IUPAC1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine
SMILESCc1cc(OCC2(N)CCCCC2)nc(C(C)C)n1
InChIInChI=1S/C15H25N3O/c1-11(2)14-17-12(3)9-13(18-14)19-10-15(16)7-5-4-6-8-15/h9,11H,4-8,10,16H2,1-3H3
InChIKeyHDJNNMUNYCJACQ-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.95
Rot. Bonds4

About 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine

1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine (PubChem CID 64572331) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine
PubChem CID64572331
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine
SMILESCc1cc(OCC2(N)CCCCC2)nc(C(C)C)n1
InChIInChI=1S/C15H25N3O/c1-11(2)14-17-12(3)9-13(18-14)19-10-15(16)7-5-4-6-8-15/h9,11H,4-8,10,16H2,1-3H3
InChIKeyHDJNNMUNYCJACQ-UHFFFAOYSA-N
XLogP2.95
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine?
The IUPAC name of 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine (CID 64572331) is 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine.
What is the SMILES notation for 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine?
The canonical SMILES for 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine is Cc1cc(OCC2(N)CCCCC2)nc(C(C)C)n1.
What is the InChIKey of 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine?
The InChIKey is HDJNNMUNYCJACQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)14-17-12(3)9-13(18-14)19-10-15(16)7-5-4-6-8-15/h9,11H,4-8,10,16H2,1-3H3.
What are the key properties of 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine?
1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]cyclohexan-1-amine is sourced from PubChem (CID 64572331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).