2-(2-methylpyrimidin-5-yl)propan-2-amine

C8H13N3 — CID 82417261

IUPAC2-(2-methylpyrimidin-5-yl)propan-2-amine
SMILESCc1ncc(C(C)(C)N)cn1
InChIInChI=1S/C8H13N3/c1-6-10-4-7(5-11-6)8(2,3)9/h4-5H,9H2,1-3H3
InChIKeyCMEZMPFZQTXHJC-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.98
Rot. Bonds1

About 2-(2-methylpyrimidin-5-yl)propan-2-amine

2-(2-methylpyrimidin-5-yl)propan-2-amine (PubChem CID 82417261) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 2-(2-methylpyrimidin-5-yl)propan-2-amine.

Molecular Properties

Compound Name2-(2-methylpyrimidin-5-yl)propan-2-amine
PubChem CID82417261
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name2-(2-methylpyrimidin-5-yl)propan-2-amine
SMILESCc1ncc(C(C)(C)N)cn1
InChIInChI=1S/C8H13N3/c1-6-10-4-7(5-11-6)8(2,3)9/h4-5H,9H2,1-3H3
InChIKeyCMEZMPFZQTXHJC-UHFFFAOYSA-N
XLogP0.98
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrimidin-5-yl)propan-2-amine?
The IUPAC name of 2-(2-methylpyrimidin-5-yl)propan-2-amine (CID 82417261) is 2-(2-methylpyrimidin-5-yl)propan-2-amine.
What is the SMILES notation for 2-(2-methylpyrimidin-5-yl)propan-2-amine?
The canonical SMILES for 2-(2-methylpyrimidin-5-yl)propan-2-amine is Cc1ncc(C(C)(C)N)cn1.
What is the InChIKey of 2-(2-methylpyrimidin-5-yl)propan-2-amine?
The InChIKey is CMEZMPFZQTXHJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-6-10-4-7(5-11-6)8(2,3)9/h4-5H,9H2,1-3H3.
What are the key properties of 2-(2-methylpyrimidin-5-yl)propan-2-amine?
2-(2-methylpyrimidin-5-yl)propan-2-amine has a molecular weight of 151.21 g/mol, XLogP of 0.98, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrimidin-5-yl)propan-2-amine is sourced from PubChem (CID 82417261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).