2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine

C17H22N4 — CID 56767062

IUPAC2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine
SMILESCCc1nc(NC2CCNCC2)cc(-c2ccccc2)n1
InChIInChI=1S/C17H22N4/c1-2-16-20-15(13-6-4-3-5-7-13)12-17(21-16)19-14-8-10-18-11-9-14/h3-7,12,14,18H,2,8-11H2,1H3,(H,19,20,21)
InChIKeyUVUGRXIYNXVWRA-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.87
Rot. Bonds4

About 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine

2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine (PubChem CID 56767062) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine
PubChem CID56767062
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC Name2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine
SMILESCCc1nc(NC2CCNCC2)cc(-c2ccccc2)n1
InChIInChI=1S/C17H22N4/c1-2-16-20-15(13-6-4-3-5-7-13)12-17(21-16)19-14-8-10-18-11-9-14/h3-7,12,14,18H,2,8-11H2,1H3,(H,19,20,21)
InChIKeyUVUGRXIYNXVWRA-UHFFFAOYSA-N
XLogP2.87
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine
CID 94075343
4-phenyl-N-piperidin-4-ylquinolin-2-amine
CID 170459367
2-ethyl-N-(piperidin-4-ylmethyl)-6-pyridin-2-ylpyrimidin-4-amine
CID 56768213
4-N-cyclopropyl-6-phenylpyrimidine-2,4-diamine
CID 117081020
N-piperidin-4-yl-2-propan-2-yl-6-pyridin-3-ylpyrimidin-4-amine
CID 56767060
2-(2-fluorophenyl)-N-piperidin-4-yl-6-pyridin-4-ylpyrimidin-4-amine
CID 56766985
2-N-benzyl-4-N-cyclopropyl-2-N-ethyl-6-phenylpyrimidine-2,4-diamine
CID 112932954
6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine
CID 56766967
N-cyclopropyl-2-(4-methylpiperazin-1-yl)-6-phenylpyrimidin-4-amine
CID 112932936
4-N-cyclopropyl-2-N-(2-methylpropyl)-6-phenylpyrimidine-2,4-diamine
CID 112932921
N-methyl-6-phenyl-2-propylpyrimidin-4-amine
CID 55045530
4-N-cyclobutyl-2-ethylpyrimidine-4,6-diamine
CID 80934753

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine?
The IUPAC name of 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine (CID 56767062) is 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine?
The canonical SMILES for 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine is CCc1nc(NC2CCNCC2)cc(-c2ccccc2)n1.
What is the InChIKey of 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine?
The InChIKey is UVUGRXIYNXVWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-2-16-20-15(13-6-4-3-5-7-13)12-17(21-16)19-14-8-10-18-11-9-14/h3-7,12,14,18H,2,8-11H2,1H3,(H,19,20,21).
What are the key properties of 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine?
2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine has a molecular weight of 282.39 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 56767062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).