N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine

C16H26N4 — CID 110271273

IUPACN-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine
SMILESCc1nc(NC2CCCCC2)cc(C2CCCNC2)n1
InChIInChI=1S/C16H26N4/c1-12-18-15(13-6-5-9-17-11-13)10-16(19-12)20-14-7-3-2-4-8-14/h10,13-14,17H,2-9,11H2,1H3,(H,18,19,20)
InChIKeyBJNMNGOOVXZNDK-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.00
Rot. Bonds3

About N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine

N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine (PubChem CID 110271273) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine
PubChem CID110271273
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC NameN-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine
SMILESCc1nc(NC2CCCCC2)cc(C2CCCNC2)n1
InChIInChI=1S/C16H26N4/c1-12-18-15(13-6-5-9-17-11-13)10-16(19-12)20-14-7-3-2-4-8-14/h10,13-14,17H,2-9,11H2,1H3,(H,18,19,20)
InChIKeyBJNMNGOOVXZNDK-UHFFFAOYSA-N
XLogP3.00
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine?
The IUPAC name of N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine (CID 110271273) is N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine.
What is the SMILES notation for N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine?
The canonical SMILES for N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine is Cc1nc(NC2CCCCC2)cc(C2CCCNC2)n1.
What is the InChIKey of N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine?
The InChIKey is BJNMNGOOVXZNDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-12-18-15(13-6-5-9-17-11-13)10-16(19-12)20-14-7-3-2-4-8-14/h10,13-14,17H,2-9,11H2,1H3,(H,18,19,20).
What are the key properties of N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine?
N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine has a molecular weight of 274.41 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-methyl-6-piperidin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 110271273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).