N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine

C18H25N3 — CID 63485062

IUPACN-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine
SMILESCCNc1cc(C(C)C)nc(-c2ccc(C(C)C)cc2)n1
InChIInChI=1S/C18H25N3/c1-6-19-17-11-16(13(4)5)20-18(21-17)15-9-7-14(8-10-15)12(2)3/h7-13H,6H2,1-5H3,(H,19,20,21)
InChIKeyOYURDHSIBGORON-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.82
Rot. Bonds5

About N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine

N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine (PubChem CID 63485062) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine
PubChem CID63485062
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine
SMILESCCNc1cc(C(C)C)nc(-c2ccc(C(C)C)cc2)n1
InChIInChI=1S/C18H25N3/c1-6-19-17-11-16(13(4)5)20-18(21-17)15-9-7-14(8-10-15)12(2)3/h7-13H,6H2,1-5H3,(H,19,20,21)
InChIKeyOYURDHSIBGORON-UHFFFAOYSA-N
XLogP4.82
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-phenyl-6-propan-2-ylpyrimidin-4-amine
CID 62191461
N-ethyl-2-(6-methoxy-3-pyridinyl)-6-propan-2-ylpyrimidin-4-amine
CID 114938334
2-(4-ethylsulfanylphenyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
CID 106849521
N-ethyl-2-methyl-6-propan-2-ylpyrimidin-4-amine
CID 62191118
N-ethyl-2,6-di(propan-2-yl)pyrimidin-4-amine
CID 62191637
N,2-diethyl-6-(4-propan-2-ylphenyl)pyrimidin-4-amine
CID 80936235
N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine
CID 114554287
N-ethyl-2-(2-methylfuran-3-yl)-6-propan-2-ylpyrimidin-4-amine
CID 113453441
2-(3,5-dichlorophenyl)-6-propan-2-yl-N-propylpyrimidin-4-amine
CID 63480501
2-(4-bromo-2-methylphenyl)-N-ethyl-6-propan-2-ylpyrimidin-4-amine
CID 103083750
N-ethyl-6-propan-2-yl-2-(1,3-thiazol-2-yl)pyrimidin-4-amine
CID 113373108
2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyrimidin-4-amine
CID 79088441

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine (CID 63485062) is N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine is CCNc1cc(C(C)C)nc(-c2ccc(C(C)C)cc2)n1.
What is the InChIKey of N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine?
The InChIKey is OYURDHSIBGORON-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-6-19-17-11-16(13(4)5)20-18(21-17)15-9-7-14(8-10-15)12(2)3/h7-13H,6H2,1-5H3,(H,19,20,21).
What are the key properties of N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine?
N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine has a molecular weight of 283.42 g/mol, XLogP of 4.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 63485062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).