N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide

C11H20N4O — CID 43214590

IUPACN,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide
SMILESCc1nn(C)c(C)c1CNCC(=O)N(C)C
InChIInChI=1S/C11H20N4O/c1-8-10(9(2)15(5)13-8)6-12-7-11(16)14(3)4/h12H,6-7H2,1-5H3
InChIKeyDIEUOFZPTHYKOP-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.21
Rot. Bonds4

About N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide

N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide (PubChem CID 43214590) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide
PubChem CID43214590
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC NameN,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide
SMILESCc1nn(C)c(C)c1CNCC(=O)N(C)C
InChIInChI=1S/C11H20N4O/c1-8-10(9(2)15(5)13-8)6-12-7-11(16)14(3)4/h12H,6-7H2,1-5H3
InChIKeyDIEUOFZPTHYKOP-UHFFFAOYSA-N
XLogP0.21
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(trimethyl-1H-pyrazol-4-yl)methyl]piperazine
CID 6485353
N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(1-isobutyl-3-oxo-2-piperazinyl)acetamide
CID 16190571
1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]piperazine
CID 7175809
[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl](methyl)amine
CID 7022224
Sbb010340
CID 6492580
2-[1-(2,2-dimethylpropyl)-3-oxopiperazin-2-yl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]acetamide
CID 16191037
1-Cyclohexyl-4-[[3,5-dimethyl-1-(2-methylprop-2-enyl)pyrazol-4-yl]methyl]piperazin-2-one
CID 25914578
1-Cyclohexyl-4-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]piperazin-2-one
CID 46963063
5-hydroxy-N-isopropyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]pyrazine-2-carboxamide
CID 46998021
2-(4-acetylpiperazin-1-yl)-N-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 50975736
1-(2-amino-2-oxoethyl)-N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]piperidine-3-carboxamide
CID 70759029
N-(2-acetamidoethyl)-2-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]acetamide
CID 72043909

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide?
The IUPAC name of N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide (CID 43214590) is N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide?
The canonical SMILES for N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide is Cc1nn(C)c(C)c1CNCC(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide?
The InChIKey is DIEUOFZPTHYKOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-8-10(9(2)15(5)13-8)6-12-7-11(16)14(3)4/h12H,6-7H2,1-5H3.
What are the key properties of N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide?
N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide has a molecular weight of 224.31 g/mol, XLogP of 0.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide is sourced from PubChem (CID 43214590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).