2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide

C8H14N4O — CID 43547720

IUPAC2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(C)N
InChIInChI=1S/C8H14N4O/c1-4(9)8(13)10-7-5(2)11-12-6(7)3/h4H,9H2,1-3H3,(H,10,13)(H,11,12)
InChIKeyCVGZJCRSOCLRNL-UHFFFAOYSA-N
MW182.23 g/mol
LogP0.31
Rot. Bonds2

About 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide

2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide (PubChem CID 43547720) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide.

Molecular Properties

Compound Name2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
PubChem CID43547720
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(C)N
InChIInChI=1S/C8H14N4O/c1-4(9)8(13)10-7-5(2)11-12-6(7)3/h4H,9H2,1-3H3,(H,10,13)(H,11,12)
InChIKeyCVGZJCRSOCLRNL-UHFFFAOYSA-N
XLogP0.31
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide
CID 126991153
(2R,3R)-2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-methylpentanamide
CID 93240679
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylbutanamide
CID 43546964
3-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide;dihydrochloride
CID 54592690
2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
CID 79506566
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide
CID 112687011
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(2-fluorophenoxy)propanamide
CID 43546883
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 43582921
4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide
CID 55033895
1-tert-butyl-3-(3,5-dimethyl-1H-pyrazol-4-yl)urea
CID 43547022
2-(4-aminobutan-2-ylsulfanyl)-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 66229540
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3,3,3-trifluoro-2-methylpropanamide
CID 79797260

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide?
The IUPAC name of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide (CID 43547720) is 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide.
What is the SMILES notation for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide?
The canonical SMILES for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide is Cc1n[nH]c(C)c1NC(=O)C(C)N.
What is the InChIKey of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide?
The InChIKey is CVGZJCRSOCLRNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-4(9)8(13)10-7-5(2)11-12-6(7)3/h4H,9H2,1-3H3,(H,10,13)(H,11,12).
What are the key properties of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide?
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide has a molecular weight of 182.23 g/mol, XLogP of 0.31, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide is sourced from PubChem (CID 43547720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).