Basic information
- Standard SMILES
CN(c1cc(C(=O)Nc2ccc(O)cc2)ncn1)C1CCCCC1- InChIKey
UDFOJJYFSUBZEJ-UHFFFAOYSA-N- Molecular formula
- C18H22N4O2
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.17427596
Names & identifiers
- Preferred name
- 6-(cyclohexyl(methyl)amino)-N-(4-hydroxyphenyl)pyrimidine-4-carboxamide
- IUPAC
- 6-[cyclohexyl(methyl)amino]-N-(4-hydroxyphenyl)pyrimidine-4-carboxamide
Names & synonyms
CHEMBL10812706-(cyclohexyl(methyl)amino)-N-(4-hydroxyphenyl)pyrimidine-4-carboxamide6-[cyclohexyl(methyl)amino]-N-(4-hydroxyphenyl)pyrimidine-4-carboxamideSCHEMBL3032892UDFOJJYFSUBZEJ-UHFFFAOYSA-NBDBM50313320
Database identifiers
- PubChem CID
- 25182758
- ChEMBL
CHEMBL1081270
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 406
Related reactions
2 records
Linked notes
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