N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide

C7H11N3O — CID 60767985

IUPACN-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide
SMILESCC(=O)NCc1cn[nH]c1C
InChIInChI=1S/C7H11N3O/c1-5-7(4-9-10-5)3-8-6(2)11/h4H,3H2,1-2H3,(H,8,11)(H,9,10)
InChIKeyQHDBROWIENAZIU-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.35
Rot. Bonds2

About N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide

N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide (PubChem CID 60767985) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide
PubChem CID60767985
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide
SMILESCC(=O)NCc1cn[nH]c1C
InChIInChI=1S/C7H11N3O/c1-5-7(4-9-10-5)3-8-6(2)11/h4H,3H2,1-2H3,(H,8,11)(H,9,10)
InChIKeyQHDBROWIENAZIU-UHFFFAOYSA-N
XLogP0.35
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-((1H-pyrazol-4-yl)methyl)acetamide
CID 60756752
N-Methyl-N-[(3-methyl-1H-pyrazol-4-yl)methyl]amine
CID 23005762
methyl((3-methyl-1H-pyrazol-4-yl)methyl)amine dihydrochloride
CID 121553850
5-methyl-N-(2-sulfanylethyl)-1H-pyrazole-4-carboxamide
CID 177680541
2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}propan-1-ol
CID 43663748
2-[(5-methyl-1H-pyrazol-4-yl)methylamino]-N-propan-2-ylacetamide
CID 43663763
2-methyl-1-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]piperidin-1-yl]propan-1-one
CID 43747825
1-[2-[(5-methyl-1H-pyrazol-4-yl)methylamino]ethyl]azepan-2-one
CID 56817425
2-Methyl-N-((3-methyl-1h-pyrazol-4-yl)methyl)pentanamide
CID 60767988
2-methyl-1-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}propan-2-ol
CID 63932283
N',N'-diethyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]butanediamide
CID 75425496
1-[3-[(5-methyl-1H-pyrazol-4-yl)methylamino]propyl]azepan-2-one
CID 86808383

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide?
The IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide (CID 60767985) is N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide.
What is the SMILES notation for N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide?
The canonical SMILES for N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide is CC(=O)NCc1cn[nH]c1C.
What is the InChIKey of N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide?
The InChIKey is QHDBROWIENAZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-5-7(4-9-10-5)3-8-6(2)11/h4H,3H2,1-2H3,(H,8,11)(H,9,10).
What are the key properties of N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide?
N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide has a molecular weight of 153.18 g/mol, XLogP of 0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide is sourced from PubChem (CID 60767985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).