N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine

C12H20N4 — CID 115305313

IUPACN,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine
SMILESCNC1(C)CCN(Cc2ncccn2)CC1
InChIInChI=1S/C12H20N4/c1-12(13-2)4-8-16(9-5-12)10-11-14-6-3-7-15-11/h3,6-7,13H,4-5,8-10H2,1-2H3
InChIKeyUWJQKCXBZPLXRM-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.05
Rot. Bonds3

About N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine

N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine (PubChem CID 115305313) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine
PubChem CID115305313
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine
SMILESCNC1(C)CCN(Cc2ncccn2)CC1
InChIInChI=1S/C12H20N4/c1-12(13-2)4-8-16(9-5-12)10-11-14-6-3-7-15-11/h3,6-7,13H,4-5,8-10H2,1-2H3
InChIKeyUWJQKCXBZPLXRM-UHFFFAOYSA-N
XLogP1.05
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine?
The IUPAC name of N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine (CID 115305313) is N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine?
The canonical SMILES for N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine is CNC1(C)CCN(Cc2ncccn2)CC1.
What is the InChIKey of N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine?
The InChIKey is UWJQKCXBZPLXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-12(13-2)4-8-16(9-5-12)10-11-14-6-3-7-15-11/h3,6-7,13H,4-5,8-10H2,1-2H3.
What are the key properties of N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine?
N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 115305313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).