2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine

C14H21N5 — CID 11856930

IUPAC2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine
SMILESCCN(CC)c1cc(C)nc(-n2nc(C)cc2C)n1
InChIInChI=1S/C14H21N5/c1-6-18(7-2)13-9-10(3)15-14(16-13)19-12(5)8-11(4)17-19/h8-9H,6-7H2,1-5H3
InChIKeyDGBGJAANMYAVCJ-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.43
Rot. Bonds4

About 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine

2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine (PubChem CID 11856930) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine
PubChem CID11856930
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine
SMILESCCN(CC)c1cc(C)nc(-n2nc(C)cc2C)n1
InChIInChI=1S/C14H21N5/c1-6-18(7-2)13-9-10(3)15-14(16-13)19-12(5)8-11(4)17-19/h8-9H,6-7H2,1-5H3
InChIKeyDGBGJAANMYAVCJ-UHFFFAOYSA-N
XLogP2.43
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine (CID 11856930) is 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine is CCN(CC)c1cc(C)nc(-n2nc(C)cc2C)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine?
The InChIKey is DGBGJAANMYAVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-6-18(7-2)13-9-10(3)15-14(16-13)19-12(5)8-11(4)17-19/h8-9H,6-7H2,1-5H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine?
2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine has a molecular weight of 259.36 g/mol, XLogP of 2.43, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-N,N-diethyl-6-methylpyrimidin-4-amine is sourced from PubChem (CID 11856930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).