N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide

C11H18N4O — CID 115773989

IUPACN,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide
SMILESCCN(CC)C(=O)CNc1ncc(C)cn1
InChIInChI=1S/C11H18N4O/c1-4-15(5-2)10(16)8-14-11-12-6-9(3)7-13-11/h6-7H,4-5,8H2,1-3H3,(H,12,13,14)
InChIKeyWGVBEXXCBDJTOL-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.07
Rot. Bonds5

About N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide

N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide (PubChem CID 115773989) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide
PubChem CID115773989
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide
SMILESCCN(CC)C(=O)CNc1ncc(C)cn1
InChIInChI=1S/C11H18N4O/c1-4-15(5-2)10(16)8-14-11-12-6-9(3)7-13-11/h6-7H,4-5,8H2,1-3H3,(H,12,13,14)
InChIKeyWGVBEXXCBDJTOL-UHFFFAOYSA-N
XLogP1.07
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,5-dimethylanilino)-N,N-diethylacetamide
CID 28582869
N,N-diethyl-2-[(5-methyl-3-nitro-2-pyridinyl)amino]acetamide
CID 115658747
2-[(5-chloropyrimidin-2-yl)amino]-N-ethyl-N-methylacetamide
CID 104925668
5-methyl-N-(2-methylidenebutyl)pyrimidin-2-amine
CID 126987115
2-[(5-bromo-3-methyl-2-pyridinyl)amino]-N,N-diethylacetamide
CID 112699018
2-[(5-iodopyrimidin-2-yl)amino]-N,N-dimethylacetamide
CID 104839937
N-ethyl-N-methyl-2-(pyrimidin-2-ylamino)acetamide
CID 104925715
2-anilino-N,N-diethylacetamide;hydrochloride
CID 119671427
N,N-diethyl-2-(4-hydroxyanilino)acetamide
CID 11806273
2,2-dimethyl-3-[(5-methylpyrimidin-2-yl)amino]propanoic acid
CID 115427683
N-[2-[(5-methylpyrimidin-2-yl)amino]ethyl]acetamide
CID 63207920
2-[(5-carbamothioyl-2-pyridinyl)amino]-N,N-diethylacetamide
CID 113406260

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide?
The IUPAC name of N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide (CID 115773989) is N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide.
What is the SMILES notation for N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide?
The canonical SMILES for N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide is CCN(CC)C(=O)CNc1ncc(C)cn1.
What is the InChIKey of N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide?
The InChIKey is WGVBEXXCBDJTOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-4-15(5-2)10(16)8-14-11-12-6-9(3)7-13-11/h6-7H,4-5,8H2,1-3H3,(H,12,13,14).
What are the key properties of N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide?
N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide has a molecular weight of 222.29 g/mol, XLogP of 1.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[(5-methylpyrimidin-2-yl)amino]acetamide is sourced from PubChem (CID 115773989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).