2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide

C10H16FN5O — CID 80820404

IUPAC2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide
SMILESCC(C)CN(CC(N)=O)c1nc(N)ncc1F
InChIInChI=1S/C10H16FN5O/c1-6(2)4-16(5-8(12)17)9-7(11)3-14-10(13)15-9/h3,6H,4-5H2,1-2H3,(H2,12,17)(H2,13,14,15)
InChIKeySWAFYOGIPWXMPG-UHFFFAOYSA-N
MW241.27 g/mol
LogP0.15
Rot. Bonds5

About 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide

2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide (PubChem CID 80820404) has the molecular formula C10H16FN5O and a molecular weight of 241.27 g/mol. Its IUPAC name is 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide
PubChem CID80820404
Molecular FormulaC10H16FN5O
Molecular Weight241.27 g/mol
Exact Mass241.13
IUPAC Name2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide
SMILESCC(C)CN(CC(N)=O)c1nc(N)ncc1F
InChIInChI=1S/C10H16FN5O/c1-6(2)4-16(5-8(12)17)9-7(11)3-14-10(13)15-9/h3,6H,4-5H2,1-2H3,(H2,12,17)(H2,13,14,15)
InChIKeySWAFYOGIPWXMPG-UHFFFAOYSA-N
XLogP0.15
TPSA98.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-amino-5-methylpyrimidin-4-yl)-(2-amino-2-oxoethyl)amino]acetamide
CID 80824373
2-[(2-amino-5-fluoropyrimidin-4-yl)-ethylamino]-N-methylacetamide
CID 80808590
2-[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide
CID 103326548
2-[6-amino-2,3-difluoro-N-(2-methylpropyl)anilino]acetamide
CID 62533871
2-[(3-amino-5-cyano-2-pyridinyl)-(2-methylpropyl)amino]acetamide
CID 103468035
2-[2-methylpropyl-(3,5,6-trichloro-2-pyridinyl)amino]acetamide
CID 102750804
2-[(5-amino-1H-1,2,4-triazol-3-yl)-(2-methylpropyl)amino]acetamide
CID 66276488
2-[[6-(1-hydroxyethyl)-3-pyridinyl]-(2-methylpropyl)amino]acetamide
CID 83132747
2-[(2-amino-2-oxoethyl)-(2-methylpropyl)amino]-6-chloropyridine-3-carboxylic acid
CID 63379944
2-[[5-amino-2-(trifluoromethyl)-4-pyridinyl]-(2-methylpropyl)amino]acetamide
CID 106747549
2-[3-amino-5-fluoro-N-(2-methylpropyl)anilino]acetamide
CID 55002568
2-[(6-amino-2-methylsulfanylpyrimidin-4-yl)-(2-methylpropyl)amino]acetamide
CID 80821516

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide?
The IUPAC name of 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide (CID 80820404) is 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide.
What is the SMILES notation for 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide?
The canonical SMILES for 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide is CC(C)CN(CC(N)=O)c1nc(N)ncc1F.
What is the InChIKey of 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide?
The InChIKey is SWAFYOGIPWXMPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FN5O/c1-6(2)4-16(5-8(12)17)9-7(11)3-14-10(13)15-9/h3,6H,4-5H2,1-2H3,(H2,12,17)(H2,13,14,15).
What are the key properties of 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide?
2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide has a molecular weight of 241.27 g/mol, XLogP of 0.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-5-fluoropyrimidin-4-yl)-(2-methylpropyl)amino]acetamide is sourced from PubChem (CID 80820404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).