3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide

C14H24N4O2 — CID 128991650

IUPAC3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide
SMILESCC(C)COCCC(=O)Nc1ccn(C2CCNC2)n1
InChIInChI=1S/C14H24N4O2/c1-11(2)10-20-8-5-14(19)16-13-4-7-18(17-13)12-3-6-15-9-12/h4,7,11-12,15H,3,5-6,8-10H2,1-2H3,(H,16,17,19)
InChIKeyQODNJODYCLEMQQ-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.42
Rot. Bonds7

About 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide

3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide (PubChem CID 128991650) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide.

Molecular Properties

Compound Name3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide
PubChem CID128991650
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide
SMILESCC(C)COCCC(=O)Nc1ccn(C2CCNC2)n1
InChIInChI=1S/C14H24N4O2/c1-11(2)10-20-8-5-14(19)16-13-4-7-18(17-13)12-3-6-15-9-12/h4,7,11-12,15H,3,5-6,8-10H2,1-2H3,(H,16,17,19)
InChIKeyQODNJODYCLEMQQ-UHFFFAOYSA-N
XLogP1.42
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-cyclohexyl-N-[1-[(3R)-pyrrolidin-3-yl]pyrazol-3-yl]propanamide
CID 129330407
2-[(1R,3R)-3-methylcyclohexyl]oxy-N-[1-[(3R)-pyrrolidin-3-yl]pyrazol-3-yl]acetamide
CID 129327739
2-[(2S)-2-methylpyrrolidin-1-yl]-N-[1-[(3R)-pyrrolidin-3-yl]pyrazol-3-yl]acetamide
CID 129341941
2-pyridin-3-yl-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide
CID 128991658
(2S)-2-(3,5-dimethylpyrazol-1-yl)-N-[1-[(3R)-pyrrolidin-3-yl]pyrazol-3-yl]propanamide
CID 129337211
1-phenyl-N-[1-[(3S)-pyrrolidin-3-yl]pyrazol-3-yl]cyclopropane-1-carboxamide
CID 129336211
N-(1-methylpyrazol-3-yl)-3-piperidin-4-yloxypropanamide
CID 63876313
2-phenyl-N-(1-pyrrolidin-3-ylpyrazol-3-yl)cyclopropane-1-carboxamide
CID 128964902
N-(1-cyclopropylpyrazol-3-yl)propanamide
CID 170387094
3-methyl-1-[(3S)-pyrrolidin-3-yl]pyrazole
CID 95366500
1-[2-(2-methylpropoxy)ethyl]-5-pyrrolidin-3-ylimidazole
CID 114722620
1-[2-(4-ethylphenyl)piperazin-1-yl]-3-(2-methylpropoxy)propan-1-one
CID 120741375

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide?
The IUPAC name of 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide (CID 128991650) is 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide.
What is the SMILES notation for 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide?
The canonical SMILES for 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide is CC(C)COCCC(=O)Nc1ccn(C2CCNC2)n1.
What is the InChIKey of 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide?
The InChIKey is QODNJODYCLEMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-11(2)10-20-8-5-14(19)16-13-4-7-18(17-13)12-3-6-15-9-12/h4,7,11-12,15H,3,5-6,8-10H2,1-2H3,(H,16,17,19).
What are the key properties of 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide?
3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide has a molecular weight of 280.37 g/mol, XLogP of 1.42, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropoxy)-N-(1-pyrrolidin-3-ylpyrazol-3-yl)propanamide is sourced from PubChem (CID 128991650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).