N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide

C10H18N4O — CID 102805551

IUPACN-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide
SMILESCCCNCC(=O)Nc1cn(C)nc1C
InChIInChI=1S/C10H18N4O/c1-4-5-11-6-10(15)12-9-7-14(3)13-8(9)2/h7,11H,4-6H2,1-3H3,(H,12,15)
InChIKeyQZIBCPOILUQBNK-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.67
Rot. Bonds5

About N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide

N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide (PubChem CID 102805551) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide.

Molecular Properties

Compound NameN-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide
PubChem CID102805551
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide
SMILESCCCNCC(=O)Nc1cn(C)nc1C
InChIInChI=1S/C10H18N4O/c1-4-5-11-6-10(15)12-9-7-14(3)13-8(9)2/h7,11H,4-6H2,1-3H3,(H,12,15)
InChIKeyQZIBCPOILUQBNK-UHFFFAOYSA-N
XLogP0.67
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(1,3-dimethylpyrazol-4-yl)-2-sulfanylacetamide
CID 102807672
N-(1,3-dimethylpyrazol-4-yl)-4-oxopentanamide
CID 102805637
2-chloro-N-[(1,3-dimethylpyrazol-4-yl)carbamoyl]acetamide
CID 102806777
N-(1,3-dimethylpyrazol-4-yl)-4-(propylamino)benzamide
CID 102807314
N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide
CID 134704539
2-(propylamino)-N-[2-[[2-(propylamino)acetyl]amino]phenyl]acetamide;hydrochloride
CID 54601113
N-(1,3-dimethylpyrazol-4-yl)-6-(propylamino)pyridazine-3-carboxamide
CID 102807260
4-amino-N-[2-[(1,3-dimethylpyrazol-4-yl)amino]-2-oxoethyl]benzamide
CID 102805519
2-(4-bromo-3-methylpyrazol-1-yl)-N-(1,3-dimethylpyrazol-4-yl)acetamide
CID 19346068
4-amino-N-(1,3-dimethylpyrazol-4-yl)-3-ethoxybutanamide
CID 114227576
N-(1,3-dimethylpyrazol-4-yl)-2-hydrazinyl-2-oxoacetamide
CID 102806911
N-(1,3-dimethylpyrazol-4-yl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 102805575

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide?
The IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide (CID 102805551) is N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide.
What is the SMILES notation for N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide?
The canonical SMILES for N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide is CCCNCC(=O)Nc1cn(C)nc1C.
What is the InChIKey of N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide?
The InChIKey is QZIBCPOILUQBNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-5-11-6-10(15)12-9-7-14(3)13-8(9)2/h7,11H,4-6H2,1-3H3,(H,12,15).
What are the key properties of N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide?
N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide has a molecular weight of 210.28 g/mol, XLogP of 0.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide is sourced from PubChem (CID 102805551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).