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

C10H18N4O — CID 104618770

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide
SMILESCCNCCC(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C10H18N4O/c1-4-11-6-5-9(15)12-10-7(2)8(3)13-14-10/h11H,4-6H2,1-3H3,(H2,12,13,14,15)
InChIKeyGQQHPASJVYXYTG-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.96
Rot. Bonds5

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

N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide (PubChem CID 104618770) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide
PubChem CID104618770
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide
SMILESCCNCCC(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C10H18N4O/c1-4-11-6-5-9(15)12-10-7(2)8(3)13-14-10/h11H,4-6H2,1-3H3,(H2,12,13,14,15)
InChIKeyGQQHPASJVYXYTG-UHFFFAOYSA-N
XLogP0.96
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104617747
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104618733
6-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,4-dimethylhexanamide
CID 104618745
5-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)hexanamide
CID 104618844
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide
CID 112689328
2-cyclopentyl-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 115610162
3-(3,4-dimethylphenoxy)-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
CID 115610256
2-[acetyl(methyl)amino]-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 115610237
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxy-3-methylbutanamide
CID 103021329
3-(1,3-benzodioxol-5-yl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
CID 115594806
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)butanamide
CID 104618696
2-(3,4-dimethylphenoxy)-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 115594824

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide (CID 104618770) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide is CCNCCC(=O)Nc1n[nH]c(C)c1C.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide?
The InChIKey is GQQHPASJVYXYTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-11-6-5-9(15)12-10-7(2)8(3)13-14-10/h11H,4-6H2,1-3H3,(H2,12,13,14,15).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide has a molecular weight of 210.28 g/mol, XLogP of 0.96, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-(ethylamino)propanamide is sourced from PubChem (CID 104618770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).