2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide

C13H23N5O — CID 80982285

IUPAC2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide
SMILESCc1c(N)nc(C(C)(C)C)nc1NC(C)(C)C(N)=O
InChIInChI=1S/C13H23N5O/c1-7-8(14)16-11(12(2,3)4)17-9(7)18-13(5,6)10(15)19/h1-6H3,(H2,15,19)(H3,14,16,17,18)
InChIKeyZMBORWHENOIWLQ-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.34
Rot. Bonds3

About 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide

2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide (PubChem CID 80982285) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide
PubChem CID80982285
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide
SMILESCc1c(N)nc(C(C)(C)C)nc1NC(C)(C)C(N)=O
InChIInChI=1S/C13H23N5O/c1-7-8(14)16-11(12(2,3)4)17-9(7)18-13(5,6)10(15)19/h1-6H3,(H2,15,19)(H3,14,16,17,18)
InChIKeyZMBORWHENOIWLQ-UHFFFAOYSA-N
XLogP1.34
TPSA106.92 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide?
The IUPAC name of 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide (CID 80982285) is 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide.
What is the SMILES notation for 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide?
The canonical SMILES for 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide is Cc1c(N)nc(C(C)(C)C)nc1NC(C)(C)C(N)=O.
What is the InChIKey of 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide?
The InChIKey is ZMBORWHENOIWLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-7-8(14)16-11(12(2,3)4)17-9(7)18-13(5,6)10(15)19/h1-6H3,(H2,15,19)(H3,14,16,17,18).
What are the key properties of 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide?
2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide has a molecular weight of 265.36 g/mol, XLogP of 1.34, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide is sourced from PubChem (CID 80982285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).