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

C10H17N3O — CID 118615626

IUPACN,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide
SMILESCc1nn(CC(=O)N(C)C)c(C)c1C
InChIInChI=1S/C10H17N3O/c1-7-8(2)11-13(9(7)3)6-10(14)12(4)5/h6H2,1-5H3
InChIKeyNUAIQVUHVZSGHZ-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.90
Rot. Bonds2

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

N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide (PubChem CID 118615626) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide
PubChem CID118615626
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide
SMILESCc1nn(CC(=O)N(C)C)c(C)c1C
InChIInChI=1S/C10H17N3O/c1-7-8(2)11-13(9(7)3)6-10(14)12(4)5/h6H2,1-5H3
InChIKeyNUAIQVUHVZSGHZ-UHFFFAOYSA-N
XLogP0.90
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4,5-trimethyl-1H-pyrazol-1-yl)acetic acid
CID 651055
2,2-dibromo-N,1-dimethyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]cyclopropanecarboxamide
CID 4070351
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
(3R)-1-[(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-3,4,4-trimethyl-3-pyrrolidinol
CID 72905600
2-(4-Ethyl-3,5-dipropylpyrazol-1-yl)acetamide
CID 1219937
(4-Propylpiperazin-1-yl)-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 40140215
N,N-diethyl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 45862482
1-(4-Propyl-1,4-diazepan-1-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanone
CID 56822440
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-propylacetamide
CID 71884635
rel-(3R,4S)-4-cyclopropyl-1-[(4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-N,N-dimethyl-3-pyrrolidinamine hydrochloride
CID 72861224
1-{2-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-2-oxoethyl}-3,4,5-trimethyl-1H-pyrazole
CID 74243529

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide (CID 118615626) is N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide is Cc1nn(CC(=O)N(C)C)c(C)c1C.
What is the InChIKey of N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide?
The InChIKey is NUAIQVUHVZSGHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7-8(2)11-13(9(7)3)6-10(14)12(4)5/h6H2,1-5H3.
What are the key properties of N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide?
N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide has a molecular weight of 195.27 g/mol, XLogP of 0.90, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(3,4,5-trimethylpyrazol-1-yl)acetamide is sourced from PubChem (CID 118615626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).