N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide

C11H19N3O — CID 19290534

IUPACN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide
SMILESCCCC(=O)NCc1cnn(CC)c1C
InChIInChI=1S/C11H19N3O/c1-4-6-11(15)12-7-10-8-13-14(5-2)9(10)3/h8H,4-7H2,1-3H3,(H,12,15)
InChIKeyIQMWTIRVBLLZLB-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.63
Rot. Bonds5

About N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide

N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide (PubChem CID 19290534) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide.

Molecular Properties

Compound NameN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide
PubChem CID19290534
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide
SMILESCCCC(=O)NCc1cnn(CC)c1C
InChIInChI=1S/C11H19N3O/c1-4-6-11(15)12-7-10-8-13-14(5-2)9(10)3/h8H,4-7H2,1-3H3,(H,12,15)
InChIKeyIQMWTIRVBLLZLB-UHFFFAOYSA-N
XLogP1.63
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)acetamide
CID 19526458
1-[2-[(1-ethyl-5-methylpyrazol-4-yl)methylamino]-2-oxoethyl]pyrazole-4-carboxylic acid
CID 19622343
2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]acetamide
CID 19525481
4-chloro-1-ethyl-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]pyrazole-5-carboxamide
CID 19477226
4-chloro-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]benzamide
CID 19290546
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-naphthalen-2-yloxyacetamide
CID 19290341
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-4-methoxybenzamide
CID 19290408
1-(4-chlorophenyl)-3-[(1-ethyl-5-methylpyrazol-4-yl)methyl]urea
CID 17378582
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]furan-2-carboxamide
CID 19290411
cis-(1R,2S)-2-[(1-ethyl-5-methylpyrazol-4-yl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 1257858
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2,3-dimethoxybenzamide
CID 35762282
4-amino-N-[(1,5-dimethylpyrazol-4-yl)methyl]butanamide
CID 106047441

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide?
The IUPAC name of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide (CID 19290534) is N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide.
What is the SMILES notation for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide?
The canonical SMILES for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide is CCCC(=O)NCc1cnn(CC)c1C.
What is the InChIKey of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide?
The InChIKey is IQMWTIRVBLLZLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-6-11(15)12-7-10-8-13-14(5-2)9(10)3/h8H,4-7H2,1-3H3,(H,12,15).
What are the key properties of N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide?
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide has a molecular weight of 209.29 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]butanamide is sourced from PubChem (CID 19290534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).