2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide

C11H18N4O2 — CID 112637058

IUPAC2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide
SMILESCC(C)Oc1ccnc(NC(C)(C)C(N)=O)n1
InChIInChI=1S/C11H18N4O2/c1-7(2)17-8-5-6-13-10(14-8)15-11(3,4)9(12)16/h5-7H,1-4H3,(H2,12,16)(H,13,14,15)
InChIKeyGWFSQNKIEZQJGM-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.94
Rot. Bonds5

About 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide

2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide (PubChem CID 112637058) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide.

Molecular Properties

Compound Name2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide
PubChem CID112637058
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide
SMILESCC(C)Oc1ccnc(NC(C)(C)C(N)=O)n1
InChIInChI=1S/C11H18N4O2/c1-7(2)17-8-5-6-13-10(14-8)15-11(3,4)9(12)16/h5-7H,1-4H3,(H2,12,16)(H,13,14,15)
InChIKeyGWFSQNKIEZQJGM-UHFFFAOYSA-N
XLogP0.94
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-3-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanoic acid
CID 112636067
N-ethyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]acetamide
CID 112636787
3-[(4-propan-2-yloxypyrimidin-2-yl)amino]butan-1-ol
CID 112638478
3-methoxy-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanoic acid
CID 112636213
4-propan-2-yloxy-N-propylpyrimidin-2-amine
CID 80860726
2,2-difluoro-N'-(4-propan-2-yloxypyrimidin-2-yl)propane-1,3-diamine
CID 114384250
6-[(4-propan-2-yloxypyrimidin-2-yl)amino]hexanoic acid
CID 112635945
N-(1-chloropropan-2-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 112639274
N-[(4-aminophenyl)methyl]-4-propan-2-yloxypyrimidin-2-amine
CID 112638872
3-[[(4-propan-2-yloxypyrimidin-2-yl)amino]methyl]pentanoic acid
CID 112636210
2-methyl-N'-(4-propan-2-yloxypyrimidin-2-yl)pentane-1,5-diamine
CID 114151108
2-[[(4-propan-2-yloxypyrimidin-2-yl)amino]methyl]cyclopentane-1-carboxylic acid
CID 115974164

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide?
The IUPAC name of 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide (CID 112637058) is 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide.
What is the SMILES notation for 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide?
The canonical SMILES for 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide is CC(C)Oc1ccnc(NC(C)(C)C(N)=O)n1.
What is the InChIKey of 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide?
The InChIKey is GWFSQNKIEZQJGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-7(2)17-8-5-6-13-10(14-8)15-11(3,4)9(12)16/h5-7H,1-4H3,(H2,12,16)(H,13,14,15).
What are the key properties of 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide?
2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide has a molecular weight of 238.29 g/mol, XLogP of 0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanamide is sourced from PubChem (CID 112637058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).