1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine

C11H20N4 — CID 79088372

IUPAC1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine
SMILESCc1cc(CC(C)N)nc(CN(C)C)n1
InChIInChI=1S/C11H20N4/c1-8(12)5-10-6-9(2)13-11(14-10)7-15(3)4/h6,8H,5,7,12H2,1-4H3
InChIKeyIPGZIFJXLVUGOC-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.74
Rot. Bonds4

About 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine

1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine (PubChem CID 79088372) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine.

Molecular Properties

Compound Name1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine
PubChem CID79088372
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine
SMILESCc1cc(CC(C)N)nc(CN(C)C)n1
InChIInChI=1S/C11H20N4/c1-8(12)5-10-6-9(2)13-11(14-10)7-15(3)4/h6,8H,5,7,12H2,1-4H3
InChIKeyIPGZIFJXLVUGOC-UHFFFAOYSA-N
XLogP0.74
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine?
The IUPAC name of 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine (CID 79088372) is 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine.
What is the SMILES notation for 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine?
The canonical SMILES for 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine is Cc1cc(CC(C)N)nc(CN(C)C)n1.
What is the InChIKey of 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine?
The InChIKey is IPGZIFJXLVUGOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-8(12)5-10-6-9(2)13-11(14-10)7-15(3)4/h6,8H,5,7,12H2,1-4H3.
What are the key properties of 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine?
1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine has a molecular weight of 208.31 g/mol, XLogP of 0.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(dimethylamino)methyl]-6-methylpyrimidin-4-yl]propan-2-amine is sourced from PubChem (CID 79088372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).