2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine

C16H23N5 — CID 82698934

IUPAC2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine
SMILESCCNc1cc(-n2nc(CC)cc2CC)nc(C2CC2)n1
InChIInChI=1S/C16H23N5/c1-4-12-9-13(5-2)21(20-12)15-10-14(17-6-3)18-16(19-15)11-7-8-11/h9-11H,4-8H2,1-3H3,(H,17,18,19)
InChIKeyQNMSQZZBHUJWPR-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.10
Rot. Bonds6

About 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine

2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine (PubChem CID 82698934) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine
PubChem CID82698934
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine
SMILESCCNc1cc(-n2nc(CC)cc2CC)nc(C2CC2)n1
InChIInChI=1S/C16H23N5/c1-4-12-9-13(5-2)21(20-12)15-10-14(17-6-3)18-16(19-15)11-7-8-11/h9-11H,4-8H2,1-3H3,(H,17,18,19)
InChIKeyQNMSQZZBHUJWPR-UHFFFAOYSA-N
XLogP3.10
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3,5-diethylpyrazol-1-yl)-N-ethylpyridin-2-amine
CID 82699860
2-cyclopropyl-6-(4,5-dimethylimidazol-1-yl)-N-ethylpyrimidin-4-amine
CID 80966773
2-cyclopropyl-N-ethyl-6-(2-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80967631
6-(4-chloro-3-methylpyrazol-1-yl)-2-cyclopropyl-N-ethylpyrimidin-4-amine
CID 80965540
2-cyclooctyl-N,6-diethylpyrimidin-4-amine
CID 80609911
2-cyclopropyl-N-ethyl-6-(4-methylpyrazol-1-yl)pyrimidin-4-amine
CID 80965817
1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80956690
6-(4-chloropyrazol-1-yl)-2-cyclopropyl-N-ethylpyrimidin-4-amine
CID 80966016
2-cyclopropyl-N-ethyl-6-(4-iodopyrazol-1-yl)pyrimidin-4-amine
CID 80966267
2-cyclopropyl-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 62320790
N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine
CID 65415234
[1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
CID 80967620

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine (CID 82698934) is 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine is CCNc1cc(-n2nc(CC)cc2CC)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine?
The InChIKey is QNMSQZZBHUJWPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-4-12-9-13(5-2)21(20-12)15-10-14(17-6-3)18-16(19-15)11-7-8-11/h9-11H,4-8H2,1-3H3,(H,17,18,19).
What are the key properties of 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine?
2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine has a molecular weight of 285.39 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine is sourced from PubChem (CID 82698934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).