2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide

C13H23N5O — CID 80934886

IUPAC2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide
SMILESCCCNc1cc(NC(C)(C)C(N)=O)nc(CC)n1
InChIInChI=1S/C13H23N5O/c1-5-7-15-10-8-11(17-9(6-2)16-10)18-13(3,4)12(14)19/h8H,5-7H2,1-4H3,(H2,14,19)(H2,15,16,17,18)
InChIKeyZEADZPQIULVRFC-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.54
Rot. Bonds7

About 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide

2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide (PubChem CID 80934886) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide
PubChem CID80934886
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide
SMILESCCCNc1cc(NC(C)(C)C(N)=O)nc(CC)n1
InChIInChI=1S/C13H23N5O/c1-5-7-15-10-8-11(17-9(6-2)16-10)18-13(3,4)12(14)19/h8H,5-7H2,1-4H3,(H2,14,19)(H2,15,16,17,18)
InChIKeyZEADZPQIULVRFC-UHFFFAOYSA-N
XLogP1.54
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide
CID 80933122
3-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80933202
2-ethyl-6-N-propyl-4-N-(3,3,3-trifluoropropyl)pyrimidine-4,6-diamine
CID 80935134
4-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]butanamide
CID 80933799
2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea
CID 83117256
2-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]ethylurea
CID 83118223
2-[(2-ethyl-6-oxo-1H-pyrimidin-4-yl)amino]-2-methylpropanamide
CID 136974611
2-[2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]acetamide
CID 106242008
2-ethyl-4-N-(4-methylpentyl)-6-N-propylpyrimidine-4,6-diamine
CID 80935431
2-ethyl-4-N-(3-methylsulfanylpropyl)-6-N-propylpyrimidine-4,6-diamine
CID 80935369
2-[(2-tert-butyl-6-hydrazinylpyrimidin-4-yl)amino]-2-methylpropanamide
CID 80964023
3-[(6-chloro-2-ethylpyrimidin-4-yl)amino]propanamide
CID 80936690

Frequently Asked Questions

What is the IUPAC name of 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide?
The IUPAC name of 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide (CID 80934886) is 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide.
What is the SMILES notation for 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide?
The canonical SMILES for 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide is CCCNc1cc(NC(C)(C)C(N)=O)nc(CC)n1.
What is the InChIKey of 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide?
The InChIKey is ZEADZPQIULVRFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-5-7-15-10-8-11(17-9(6-2)16-10)18-13(3,4)12(14)19/h8H,5-7H2,1-4H3,(H2,14,19)(H2,15,16,17,18).
What are the key properties of 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide?
2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide has a molecular weight of 265.36 g/mol, XLogP of 1.54, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]-2-methylpropanamide is sourced from PubChem (CID 80934886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).