6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine

C16H27N3 — CID 65402392

IUPAC6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
SMILESCCc1nc(C2CCC(C(C)C)CC2)nc(N)c1C
InChIInChI=1S/C16H27N3/c1-5-14-11(4)15(17)19-16(18-14)13-8-6-12(7-9-13)10(2)3/h10,12-13H,5-9H2,1-4H3,(H2,17,18,19)
InChIKeyKGJSXIMVHQMQHV-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.86
Rot. Bonds3

About 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine

6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine (PubChem CID 65402392) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
PubChem CID65402392
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
SMILESCCc1nc(C2CCC(C(C)C)CC2)nc(N)c1C
InChIInChI=1S/C16H27N3/c1-5-14-11(4)15(17)19-16(18-14)13-8-6-12(7-9-13)10(2)3/h10,12-13H,5-9H2,1-4H3,(H2,17,18,19)
InChIKeyKGJSXIMVHQMQHV-UHFFFAOYSA-N
XLogP3.86
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclobutyl-6-ethyl-5-methylpyrimidin-4-amine
CID 64985726
2-cyclohexyl-6-ethyl-5-methylpyrimidin-4-amine
CID 63559786
5,6-dimethyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
CID 65401369
6-ethyl-5-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine
CID 65402391
6-ethyl-5-methyl-2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pyrimidin-4-amine
CID 112681659
5-bromo-6-propan-2-yl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
CID 66298717
4-cyclopentyl-6-(4-propan-2-ylcyclohexyl)-1,3,5-triazin-2-amine
CID 65401606
6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
CID 65400159
4-N-butan-2-yl-2-cyclopropyl-5-methylpyrimidine-4,6-diamine
CID 80980857
2-cyclopropyl-5-methyl-4-N-(2-methyl-3-methylsulfanylpropyl)pyrimidine-4,6-diamine
CID 80985077
2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine
CID 80991192
2-[cyclohexyl(ethoxy)methyl]-6-ethyl-5-methylpyrimidin-4-amine
CID 116776337

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine?
The IUPAC name of 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine (CID 65402392) is 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine is CCc1nc(C2CCC(C(C)C)CC2)nc(N)c1C.
What is the InChIKey of 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine?
The InChIKey is KGJSXIMVHQMQHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-5-14-11(4)15(17)19-16(18-14)13-8-6-12(7-9-13)10(2)3/h10,12-13H,5-9H2,1-4H3,(H2,17,18,19).
What are the key properties of 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine?
6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine has a molecular weight of 261.41 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine is sourced from PubChem (CID 65402392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).