2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine

C15H25N3 — CID 65415033

IUPAC2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine
SMILESCCC1CCCC(c2nc(N)cc(C(C)C)n2)C1
InChIInChI=1S/C15H25N3/c1-4-11-6-5-7-12(8-11)15-17-13(10(2)3)9-14(16)18-15/h9-12H,4-8H2,1-3H3,(H2,16,17,18)
InChIKeyQOBHEFXXLBGHDG-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.87
Rot. Bonds3

About 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine

2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine (PubChem CID 65415033) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine
PubChem CID65415033
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine
SMILESCCC1CCCC(c2nc(N)cc(C(C)C)n2)C1
InChIInChI=1S/C15H25N3/c1-4-11-6-5-7-12(8-11)15-17-13(10(2)3)9-14(16)18-15/h9-12H,4-8H2,1-3H3,(H2,16,17,18)
InChIKeyQOBHEFXXLBGHDG-UHFFFAOYSA-N
XLogP3.87
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-butan-2-yl-2-cyclopropylpyrimidin-4-amine
CID 122238996
1-[2-(3-ethylcyclohexyl)-6-methylpyrimidin-4-yl]propan-2-amine
CID 65414649
(1R)-1-[3-(3-ethylcyclohexyl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 104899805
(1S)-1-[3-(3-ethylcyclohexyl)-1,2,4-oxadiazol-5-yl]-2-methylpropan-1-amine
CID 104901665
N-[[2-(3-ethylcyclohexyl)-6-methylpyrimidin-4-yl]methyl]propan-2-amine
CID 65415249
4-cyclopentyl-6-(3-ethylcyclopentyl)-1,3,5-triazin-2-amine
CID 65404534
5-[3-(3-ethylcyclohexyl)-1,2,4-oxadiazol-5-yl]-1H-pyrazol-3-amine
CID 65401824
[2-(3-ethylcyclohexyl)pyrimidin-4-yl]methanol
CID 65415658
6-cyclopropyl-2-(3-ethylcyclohexyl)-5-iodopyrimidin-4-amine
CID 66304402
N-ethyl-2-(3-ethylcyclohexyl)pyrimidin-4-amine
CID 65413212
[2-(3-ethylcyclohexyl)-6-methylpyrimidin-4-yl]methanol
CID 65415858
1-[2-(3-ethylcyclohexyl)-1,3-thiazol-4-yl]ethanamine
CID 65415626

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine (CID 65415033) is 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine is CCC1CCCC(c2nc(N)cc(C(C)C)n2)C1.
What is the InChIKey of 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is QOBHEFXXLBGHDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-11-6-5-7-12(8-11)15-17-13(10(2)3)9-14(16)18-15/h9-12H,4-8H2,1-3H3,(H2,16,17,18).
What are the key properties of 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine?
2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 65415033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).