N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide

C9H15N3O2 — CID 35761217

IUPACN-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide
SMILESCOCCC(=O)Nc1cc(C)n(C)n1
InChIInChI=1S/C9H15N3O2/c1-7-6-8(11-12(7)2)10-9(13)4-5-14-3/h6H,4-5H2,1-3H3,(H,10,11,13)
InChIKeyNWMLKPKVJHVOIP-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.70
Rot. Bonds4

About N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide

N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide (PubChem CID 35761217) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide
PubChem CID35761217
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide
SMILESCOCCC(=O)Nc1cc(C)n(C)n1
InChIInChI=1S/C9H15N3O2/c1-7-6-8(11-12(7)2)10-9(13)4-5-14-3/h6H,4-5H2,1-3H3,(H,10,11,13)
InChIKeyNWMLKPKVJHVOIP-UHFFFAOYSA-N
XLogP0.70
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-(1,5-dimethylpyrazol-3-yl)acetamide
CID 130496766
N-(1,5-dimethylpyrazol-3-yl)-3-phenylpropanamide
CID 35761194
3-amino-N-(1,5-dimethylpyrazol-3-yl)propanamide;4-[(1,5-dimethylpyrazol-3-yl)amino]-4-oxobutanoic acid;hydrochloride
CID 161136989
N-(1,5-dimethylpyrazol-3-yl)-4-(propan-2-ylamino)butanamide
CID 114253600
1-tert-butyl-3-(1,5-dimethylpyrazol-3-yl)urea
CID 108813276
N-(2-methoxyethyl)-1,5-dimethylpyrazole-3-carboxamide
CID 19279762
3-amino-N-(1,5-dimethylpyrazol-3-yl)-4,4-dimethylpentanamide
CID 114253602
3-(1,5-dimethylpyrazol-3-yl)-1-(1,1-dioxothiolan-3-yl)-1-(2-methoxyethyl)urea
CID 108813418
(2S)-N-(1,5-dimethylpyrazol-3-yl)-2-(methylamino)propanamide
CID 126982193
4-bromo-N-(1,5-dimethylpyrazol-3-yl)benzamide
CID 35761193
2-bromo-N-(1,5-dimethylpyrazol-3-yl)benzamide
CID 39854030
2-bromo-N-(1,5-dimethylpyrazol-3-yl)butanamide
CID 130496769

Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide?
The IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide (CID 35761217) is N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide.
What is the SMILES notation for N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide?
The canonical SMILES for N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide is COCCC(=O)Nc1cc(C)n(C)n1.
What is the InChIKey of N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide?
The InChIKey is NWMLKPKVJHVOIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-7-6-8(11-12(7)2)10-9(13)4-5-14-3/h6H,4-5H2,1-3H3,(H,10,11,13).
What are the key properties of N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide?
N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide has a molecular weight of 197.24 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazol-3-yl)-3-methoxypropanamide is sourced from PubChem (CID 35761217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).