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

C14H23N3 — CID 65400159

IUPAC6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
SMILESCc1cc(N)nc(C2CCC(C(C)C)CC2)n1
InChIInChI=1S/C14H23N3/c1-9(2)11-4-6-12(7-5-11)14-16-10(3)8-13(15)17-14/h8-9,11-12H,4-7H2,1-3H3,(H2,15,16,17)
InChIKeyFEHNNCKZWLNMGG-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.30
Rot. Bonds2

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

6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine (PubChem CID 65400159) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
PubChem CID65400159
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
SMILESCc1cc(N)nc(C2CCC(C(C)C)CC2)n1
InChIInChI=1S/C14H23N3/c1-9(2)11-4-6-12(7-5-11)14-16-10(3)8-13(15)17-14/h8-9,11-12H,4-7H2,1-3H3,(H2,15,16,17)
InChIKeyFEHNNCKZWLNMGG-UHFFFAOYSA-N
XLogP3.30
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine?
The IUPAC name of 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine (CID 65400159) is 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine is Cc1cc(N)nc(C2CCC(C(C)C)CC2)n1.
What is the InChIKey of 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine?
The InChIKey is FEHNNCKZWLNMGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-9(2)11-4-6-12(7-5-11)14-16-10(3)8-13(15)17-14/h8-9,11-12H,4-7H2,1-3H3,(H2,15,16,17).
What are the key properties of 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine?
6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine is sourced from PubChem (CID 65400159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).