N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine

C15H23N5 — CID 115990720

IUPACN-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine
SMILESCCNc1cc(C(C)C)nc(-c2cn(C)nc2CC)n1
InChIInChI=1S/C15H23N5/c1-6-12-11(9-20(5)19-12)15-17-13(10(3)4)8-14(18-15)16-7-2/h8-10H,6-7H2,1-5H3,(H,16,17,18)
InChIKeyDUCMPYJKOKPHSR-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.99
Rot. Bonds5

About N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine

N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine (PubChem CID 115990720) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine
PubChem CID115990720
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC NameN-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine
SMILESCCNc1cc(C(C)C)nc(-c2cn(C)nc2CC)n1
InChIInChI=1S/C15H23N5/c1-6-12-11(9-20(5)19-12)15-17-13(10(3)4)8-14(18-15)16-7-2/h8-10H,6-7H2,1-5H3,(H,16,17,18)
InChIKeyDUCMPYJKOKPHSR-UHFFFAOYSA-N
XLogP2.99
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine
CID 115990831
N-ethyl-2-methyl-6-propan-2-ylpyrimidin-4-amine
CID 62191118
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
N-ethyl-6-propan-2-yl-2-(3-propylimidazol-4-yl)pyrimidin-4-amine
CID 66141086
2-(3-ethyl-1-methylpyrazol-4-yl)-4-propan-2-yl-1H-pyrimidin-6-one
CID 136920201
2-(4-bromo-2-methylphenyl)-N-ethyl-6-propan-2-ylpyrimidin-4-amine
CID 103083750
N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine
CID 63485062
N-ethyl-2,6-di(propan-2-yl)pyrimidin-4-amine
CID 62191637
2-(4,5-dibromothiophen-2-yl)-N-ethyl-6-propan-2-ylpyrimidin-4-amine
CID 102843798
5-bromo-4-chloro-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidine
CID 112670230
2-(3-cyclopropylimidazol-4-yl)-N-ethyl-6-propan-2-ylpyrimidin-4-amine
CID 66163526

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine (CID 115990720) is N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine is CCNc1cc(C(C)C)nc(-c2cn(C)nc2CC)n1.
What is the InChIKey of N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is DUCMPYJKOKPHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-6-12-11(9-20(5)19-12)15-17-13(10(3)4)8-14(18-15)16-7-2/h8-10H,6-7H2,1-5H3,(H,16,17,18).
What are the key properties of N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine?
N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 273.38 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 115990720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).