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

C9H16N4O2 — CID 104618673

IUPAC2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C9H16N4O2/c1-5-6(2)12-13-8(5)11-9(14)7(10)4-15-3/h7H,4,10H2,1-3H3,(H2,11,12,13,14)
InChIKeyOEWVERPHXJFIQJ-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.06
Rot. Bonds4

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

2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide (PubChem CID 104618673) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide
PubChem CID104618673
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C9H16N4O2/c1-5-6(2)12-13-8(5)11-9(14)7(10)4-15-3/h7H,4,10H2,1-3H3,(H2,11,12,13,14)
InChIKeyOEWVERPHXJFIQJ-UHFFFAOYSA-N
XLogP-0.06
TPSA93.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide
CID 104618869
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)butanamide
CID 104618696
3-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-methoxypropanamide
CID 106113701
(2S)-2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)hexanamide
CID 107146509
2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
CID 115624602
2-amino-3-methoxy-N-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)propanamide;hydrochloride
CID 120987482
3-[(2-amino-3-hydroxypropanoyl)amino]-5-methyl-1H-pyrazole-4-carboxylic acid
CID 110480754
5-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)hexanamide
CID 104618844
2-chloro-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104617747
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxy-3-methylbutanamide
CID 103021329
2-(carbamoylamino)-N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-methylsulfanylbutanamide
CID 112689375
2-amino-N-(2,4-dimethyl-1,3-thiazol-5-yl)-3-methoxypropanamide;hydrochloride
CID 120992010

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide?
The IUPAC name of 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide (CID 104618673) is 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide is COCC(N)C(=O)Nc1n[nH]c(C)c1C.
What is the InChIKey of 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide?
The InChIKey is OEWVERPHXJFIQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2/c1-5-6(2)12-13-8(5)11-9(14)7(10)4-15-3/h7H,4,10H2,1-3H3,(H2,11,12,13,14).
What are the key properties of 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide?
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide has a molecular weight of 212.25 g/mol, XLogP of -0.06, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide is sourced from PubChem (CID 104618673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).