N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine

C15H20N6 — CID 95816988

IUPACN,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine
SMILESCN(C)c1nccc(C2CCN(c3ncccn3)CC2)n1
InChIInChI=1S/C15H20N6/c1-20(2)15-18-9-4-13(19-15)12-5-10-21(11-6-12)14-16-7-3-8-17-14/h3-4,7-9,12H,5-6,10-11H2,1-2H3
InChIKeyMCHMYSMKXYRXCB-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.72
Rot. Bonds3

About N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine

N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine (PubChem CID 95816988) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine
PubChem CID95816988
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC NameN,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine
SMILESCN(C)c1nccc(C2CCN(c3ncccn3)CC2)n1
InChIInChI=1S/C15H20N6/c1-20(2)15-18-9-4-13(19-15)12-5-10-21(11-6-12)14-16-7-3-8-17-14/h3-4,7-9,12H,5-6,10-11H2,1-2H3
InChIKeyMCHMYSMKXYRXCB-UHFFFAOYSA-N
XLogP1.72
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine?
The IUPAC name of N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine (CID 95816988) is N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine.
What is the SMILES notation for N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine?
The canonical SMILES for N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine is CN(C)c1nccc(C2CCN(c3ncccn3)CC2)n1.
What is the InChIKey of N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine?
The InChIKey is MCHMYSMKXYRXCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-20(2)15-18-9-4-13(19-15)12-5-10-21(11-6-12)14-16-7-3-8-17-14/h3-4,7-9,12H,5-6,10-11H2,1-2H3.
What are the key properties of N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine?
N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine has a molecular weight of 284.37 g/mol, XLogP of 1.72, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(1-pyrimidin-2-ylpiperidin-4-yl)pyrimidin-2-amine is sourced from PubChem (CID 95816988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).