N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine

C14H25N3 — CID 79219467

IUPACN-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine
SMILESCCc1nc(C)nc(CC)c1CCNC(C)C
InChIInChI=1S/C14H25N3/c1-6-13-12(8-9-15-10(3)4)14(7-2)17-11(5)16-13/h10,15H,6-9H2,1-5H3
InChIKeyHUNOEFGDWCLMMZ-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.45
Rot. Bonds6

About N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine

N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine (PubChem CID 79219467) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine
PubChem CID79219467
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine
SMILESCCc1nc(C)nc(CC)c1CCNC(C)C
InChIInChI=1S/C14H25N3/c1-6-13-12(8-9-15-10(3)4)14(7-2)17-11(5)16-13/h10,15H,6-9H2,1-5H3
InChIKeyHUNOEFGDWCLMMZ-UHFFFAOYSA-N
XLogP2.45
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine (CID 79219467) is N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine is CCc1nc(C)nc(CC)c1CCNC(C)C.
What is the InChIKey of N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine?
The InChIKey is HUNOEFGDWCLMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-6-13-12(8-9-15-10(3)4)14(7-2)17-11(5)16-13/h10,15H,6-9H2,1-5H3.
What are the key properties of N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine?
N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine has a molecular weight of 235.37 g/mol, XLogP of 2.45, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,6-diethyl-2-methylpyrimidin-5-yl)ethyl]propan-2-amine is sourced from PubChem (CID 79219467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).