N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine

C11H18N4 — CID 62545669

IUPACN-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine
SMILESCNC1CCCN(c2cc(C)ncn2)C1
InChIInChI=1S/C11H18N4/c1-9-6-11(14-8-13-9)15-5-3-4-10(7-15)12-2/h6,8,10,12H,3-5,7H2,1-2H3
InChIKeyAYDDBSRFALKRMC-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.97
Rot. Bonds2

About N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine

N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine (PubChem CID 62545669) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine.

Molecular Properties

Compound NameN-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine
PubChem CID62545669
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC NameN-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine
SMILESCNC1CCCN(c2cc(C)ncn2)C1
InChIInChI=1S/C11H18N4/c1-9-6-11(14-8-13-9)15-5-3-4-10(7-15)12-2/h6,8,10,12H,3-5,7H2,1-2H3
InChIKeyAYDDBSRFALKRMC-UHFFFAOYSA-N
XLogP0.97
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine?
The IUPAC name of N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine (CID 62545669) is N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine.
What is the SMILES notation for N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine?
The canonical SMILES for N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine is CNC1CCCN(c2cc(C)ncn2)C1.
What is the InChIKey of N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine?
The InChIKey is AYDDBSRFALKRMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-9-6-11(14-8-13-9)15-5-3-4-10(7-15)12-2/h6,8,10,12H,3-5,7H2,1-2H3.
What are the key properties of N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine?
N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine has a molecular weight of 206.29 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine is sourced from PubChem (CID 62545669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).