2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine

C10H17N3 — CID 96852081

IUPAC2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine
SMILESCc1nc(C)c(C)c(C(C)(C)N)n1
InChIInChI=1S/C10H17N3/c1-6-7(2)12-8(3)13-9(6)10(4,5)11/h11H2,1-5H3
InChIKeyNCADTCQVNCFPKY-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.60
Rot. Bonds1

About 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine

2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine (PubChem CID 96852081) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine.

Molecular Properties

Compound Name2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine
PubChem CID96852081
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine
SMILESCc1nc(C)c(C)c(C(C)(C)N)n1
InChIInChI=1S/C10H17N3/c1-6-7(2)12-8(3)13-9(6)10(4,5)11/h11H2,1-5H3
InChIKeyNCADTCQVNCFPKY-UHFFFAOYSA-N
XLogP1.60
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine?
The IUPAC name of 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine (CID 96852081) is 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine.
What is the SMILES notation for 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine?
The canonical SMILES for 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine is Cc1nc(C)c(C)c(C(C)(C)N)n1.
What is the InChIKey of 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine?
The InChIKey is NCADTCQVNCFPKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-6-7(2)12-8(3)13-9(6)10(4,5)11/h11H2,1-5H3.
What are the key properties of 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine?
2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine has a molecular weight of 179.27 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine is sourced from PubChem (CID 96852081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).