4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine

C15H24N4 — CID 112856002

IUPAC4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine
SMILESCC1CCN(c2cc(N3CCCCC3)ncn2)CC1
InChIInChI=1S/C15H24N4/c1-13-5-9-19(10-6-13)15-11-14(16-12-17-15)18-7-3-2-4-8-18/h11-13H,2-10H2,1H3
InChIKeyQTCYGBYZRIPYGV-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.70
Rot. Bonds2

About 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine

4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine (PubChem CID 112856002) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine.

Molecular Properties

Compound Name4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine
PubChem CID112856002
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine
SMILESCC1CCN(c2cc(N3CCCCC3)ncn2)CC1
InChIInChI=1S/C15H24N4/c1-13-5-9-19(10-6-13)15-11-14(16-12-17-15)18-7-3-2-4-8-18/h11-13H,2-10H2,1H3
InChIKeyQTCYGBYZRIPYGV-UHFFFAOYSA-N
XLogP2.70
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine?
The IUPAC name of 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine (CID 112856002) is 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine.
What is the SMILES notation for 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine?
The canonical SMILES for 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine is CC1CCN(c2cc(N3CCCCC3)ncn2)CC1.
What is the InChIKey of 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine?
The InChIKey is QTCYGBYZRIPYGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-13-5-9-19(10-6-13)15-11-14(16-12-17-15)18-7-3-2-4-8-18/h11-13H,2-10H2,1H3.
What are the key properties of 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine?
4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine has a molecular weight of 260.38 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine is sourced from PubChem (CID 112856002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).