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

C13H19N5 — CID 114554287

IUPACN-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine
SMILESCCNc1cc(C(C)C)nc(-c2ccnn2C)n1
InChIInChI=1S/C13H19N5/c1-5-14-12-8-10(9(2)3)16-13(17-12)11-6-7-15-18(11)4/h6-9H,5H2,1-4H3,(H,14,16,17)
InChIKeyRLOARDLLMPCZHA-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.43
Rot. Bonds4

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

N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine (PubChem CID 114554287) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine
PubChem CID114554287
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC NameN-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine
SMILESCCNc1cc(C(C)C)nc(-c2ccnn2C)n1
InChIInChI=1S/C13H19N5/c1-5-14-12-8-10(9(2)3)16-13(17-12)11-6-7-15-18(11)4/h6-9H,5H2,1-4H3,(H,14,16,17)
InChIKeyRLOARDLLMPCZHA-UHFFFAOYSA-N
XLogP2.43
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-(2-methylpyrazol-3-yl)-6-phenylpyrimidin-4-amine
CID 114554308
N-ethyl-6-propan-2-yl-2-(3-propylimidazol-4-yl)pyrimidin-4-amine
CID 66141086
N-ethyl-2-phenyl-6-propan-2-ylpyrimidin-4-amine
CID 62191461
N-ethyl-6-propan-2-yl-2-(4-propan-2-ylphenyl)pyrimidin-4-amine
CID 63485062
N-ethyl-2-methyl-6-propan-2-ylpyrimidin-4-amine
CID 62191118
N-ethyl-2-(2-methylfuran-3-yl)-6-propan-2-ylpyrimidin-4-amine
CID 113453441
N-ethyl-6-propan-2-yl-2-(1,3-thiazol-2-yl)pyrimidin-4-amine
CID 113373108
2-(3-cyclopropylimidazol-4-yl)-N-ethyl-6-propan-2-ylpyrimidin-4-amine
CID 66163526
N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine
CID 115990720
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
6-(2-methylpyrazol-3-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80952418

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine (CID 114554287) is N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine is CCNc1cc(C(C)C)nc(-c2ccnn2C)n1.
What is the InChIKey of N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is RLOARDLLMPCZHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-5-14-12-8-10(9(2)3)16-13(17-12)11-6-7-15-18(11)4/h6-9H,5H2,1-4H3,(H,14,16,17).
What are the key properties of N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine?
N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 245.33 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-methylpyrazol-3-yl)-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 114554287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).