N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine

C13H24N4 — CID 54548238

IUPACN,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine
SMILESCNC1C=C(N2CCCCC2C)N=C(C)N1C
InChIInChI=1S/C13H24N4/c1-10-7-5-6-8-17(10)13-9-12(14-3)16(4)11(2)15-13/h9-10,12,14H,5-8H2,1-4H3
InChIKeyZIBVEZJRZWZFDO-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.61
Rot. Bonds2

About N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine

N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine (PubChem CID 54548238) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine.

Molecular Properties

Compound NameN,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine
PubChem CID54548238
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC NameN,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine
SMILESCNC1C=C(N2CCCCC2C)N=C(C)N1C
InChIInChI=1S/C13H24N4/c1-10-7-5-6-8-17(10)13-9-12(14-3)16(4)11(2)15-13/h9-10,12,14H,5-8H2,1-4H3
InChIKeyZIBVEZJRZWZFDO-UHFFFAOYSA-N
XLogP1.61
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine?
The IUPAC name of N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine (CID 54548238) is N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine.
What is the SMILES notation for N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine?
The canonical SMILES for N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine is CNC1C=C(N2CCCCC2C)N=C(C)N1C.
What is the InChIKey of N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine?
The InChIKey is ZIBVEZJRZWZFDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-10-7-5-6-8-17(10)13-9-12(14-3)16(4)11(2)15-13/h9-10,12,14H,5-8H2,1-4H3.
What are the key properties of N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine?
N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine has a molecular weight of 236.36 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,3-trimethyl-6-(2-methylpiperidin-1-yl)-4H-pyrimidin-4-amine is sourced from PubChem (CID 54548238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).