[5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine

C11H19N3 — CID 130337279

IUPAC[5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine
SMILESCCCC(C)(C)c1cnc(CN)nc1
InChIInChI=1S/C11H19N3/c1-4-5-11(2,3)9-7-13-10(6-12)14-8-9/h7-8H,4-6,12H2,1-3H3
InChIKeyZAKFZKBSCTWZAM-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.01
Rot. Bonds4

About [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine

[5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine (PubChem CID 130337279) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine.

Molecular Properties

Compound Name[5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine
PubChem CID130337279
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name[5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine
SMILESCCCC(C)(C)c1cnc(CN)nc1
InChIInChI=1S/C11H19N3/c1-4-5-11(2,3)9-7-13-10(6-12)14-8-9/h7-8H,4-6,12H2,1-3H3
InChIKeyZAKFZKBSCTWZAM-UHFFFAOYSA-N
XLogP2.01
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine?
The IUPAC name of [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine (CID 130337279) is [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine.
What is the SMILES notation for [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine?
The canonical SMILES for [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine is CCCC(C)(C)c1cnc(CN)nc1.
What is the InChIKey of [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine?
The InChIKey is ZAKFZKBSCTWZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-4-5-11(2,3)9-7-13-10(6-12)14-8-9/h7-8H,4-6,12H2,1-3H3.
What are the key properties of [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine?
[5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine has a molecular weight of 193.29 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methylpentan-2-yl)pyrimidin-2-yl]methanamine is sourced from PubChem (CID 130337279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).