2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide

C8H13N3O — CID 130719724

IUPAC2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide
SMILESCc1[nH]ncc1NC(=O)C(C)C
InChIInChI=1S/C8H13N3O/c1-5(2)8(12)10-7-4-9-11-6(7)3/h4-5H,1-3H3,(H,9,11)(H,10,12)
InChIKeyQUSNAQWFTQGWHI-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.31
Rot. Bonds2

About 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide

2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide (PubChem CID 130719724) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide
PubChem CID130719724
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide
SMILESCc1[nH]ncc1NC(=O)C(C)C
InChIInChI=1S/C8H13N3O/c1-5(2)8(12)10-7-4-9-11-6(7)3/h4-5H,1-3H3,(H,9,11)(H,10,12)
InChIKeyQUSNAQWFTQGWHI-UHFFFAOYSA-N
XLogP1.31
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-dimethyl-3-(5-methyl-1H-pyrazol-4-yl)urea
CID 20784611
(2S)-2-amino-N-(5-methyl-1H-pyrazol-4-yl)-3-phenylpropanamide
CID 110837650
3-(3,4-dihydroxyphenyl)-2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide
CID 112521695
N-(1H-indazol-7-yl)-2-methylpropanamide
CID 31817153
2-methyl-2-(methylamino)-N-(5-methyl-1H-pyrazol-4-yl)propanamide
CID 83618057
1-(5-methyl-1H-pyrazol-4-yl)-3-(5-methyl-2-pyridinyl)urea
CID 166404732
5-methyl-N-(5-methyl-1H-pyrazol-4-yl)-1H-pyrazole-3-carboxamide
CID 47470885
2-(3-chlorophenyl)-N-(5-methyl-1H-pyrazol-4-yl)acetamide
CID 154858274
3-amino-3-methyl-N-(5-methyl-1H-pyrazol-4-yl)butanamide
CID 83618200
N-(5-methyl-1H-pyrazol-4-yl)piperidine-2-carboxamide
CID 110837895
N-[2-(bromomethyl)phenyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 114309775
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CID 79013070

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide?
The IUPAC name of 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide (CID 130719724) is 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide?
The canonical SMILES for 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide is Cc1[nH]ncc1NC(=O)C(C)C.
What is the InChIKey of 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide?
The InChIKey is QUSNAQWFTQGWHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5(2)8(12)10-7-4-9-11-6(7)3/h4-5H,1-3H3,(H,9,11)(H,10,12).
What are the key properties of 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide?
2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide has a molecular weight of 167.21 g/mol, XLogP of 1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide is sourced from PubChem (CID 130719724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).