6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine

C14H21N5 — CID 82698482

IUPAC6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine
SMILESCCc1cc(CC)n(-c2ncnc(NC)c2CC)n1
InChIInChI=1S/C14H21N5/c1-5-10-8-11(6-2)19(18-10)14-12(7-3)13(15-4)16-9-17-14/h8-9H,5-7H2,1-4H3,(H,15,16,17)
InChIKeyDGKUMRYPJNSCNQ-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.39
Rot. Bonds5

About 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine

6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine (PubChem CID 82698482) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine
PubChem CID82698482
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine
SMILESCCc1cc(CC)n(-c2ncnc(NC)c2CC)n1
InChIInChI=1S/C14H21N5/c1-5-10-8-11(6-2)19(18-10)14-12(7-3)13(15-4)16-9-17-14/h8-9H,5-7H2,1-4H3,(H,15,16,17)
InChIKeyDGKUMRYPJNSCNQ-UHFFFAOYSA-N
XLogP2.39
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine
CID 80867685
5-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine
CID 80763765
5-ethyl-N-methyl-6-(3-methylpyrazol-1-yl)pyrimidin-4-amine
CID 80857839
4-(3,5-diethylpyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 82699253
1-[5-ethyl-6-(methylamino)pyrimidin-4-yl]-4-methylpiperidin-4-ol
CID 81108542
3-ethyl-4-[5-ethyl-6-(methylamino)pyrimidin-4-yl]piperazine-2,6-dione
CID 80851469
6-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-methyl-5-propylpyrimidin-4-amine
CID 80856969
6-(3,5-diethyl-1,2,4-triazol-1-yl)-N,5-diethylpyrimidin-4-amine
CID 80867775
5-ethyl-4-N-methylpyrimidine-4,6-diamine
CID 80770928
6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine
CID 80843439
3,5-dichloro-2-(3,5-diethylpyrazol-1-yl)pyridine
CID 82698804
4-(3,5-diethylpyrazol-1-yl)-6-propylpyrimidine
CID 82700133

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine?
The IUPAC name of 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine (CID 82698482) is 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine is CCc1cc(CC)n(-c2ncnc(NC)c2CC)n1.
What is the InChIKey of 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine?
The InChIKey is DGKUMRYPJNSCNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-5-10-8-11(6-2)19(18-10)14-12(7-3)13(15-4)16-9-17-14/h8-9H,5-7H2,1-4H3,(H,15,16,17).
What are the key properties of 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine?
6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine has a molecular weight of 259.36 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-diethylpyrazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine is sourced from PubChem (CID 82698482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).