1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine

C12H20N4 — CID 103278591

IUPAC1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine
SMILESCC(C)c1cnc(N2CCC(N)CC2)nc1
InChIInChI=1S/C12H20N4/c1-9(2)10-7-14-12(15-8-10)16-5-3-11(13)4-6-16/h7-9,11H,3-6,13H2,1-2H3
InChIKeyGDZGVCITXFWBSG-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.53
Rot. Bonds2

About 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine

1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine (PubChem CID 103278591) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine
PubChem CID103278591
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine
SMILESCC(C)c1cnc(N2CCC(N)CC2)nc1
InChIInChI=1S/C12H20N4/c1-9(2)10-7-14-12(15-8-10)16-5-3-11(13)4-6-16/h7-9,11H,3-6,13H2,1-2H3
InChIKeyGDZGVCITXFWBSG-UHFFFAOYSA-N
XLogP1.53
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine?
The IUPAC name of 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine (CID 103278591) is 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine.
What is the SMILES notation for 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine?
The canonical SMILES for 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine is CC(C)c1cnc(N2CCC(N)CC2)nc1.
What is the InChIKey of 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine?
The InChIKey is GDZGVCITXFWBSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9(2)10-7-14-12(15-8-10)16-5-3-11(13)4-6-16/h7-9,11H,3-6,13H2,1-2H3.
What are the key properties of 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine?
1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-propan-2-ylpyrimidin-2-yl)piperidin-4-amine is sourced from PubChem (CID 103278591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).