3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide

C13H22N4O — CID 113433541

IUPAC3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide
SMILESCCCc1cc(NC(=O)C2(CC)CCNC2)n[nH]1
InChIInChI=1S/C13H22N4O/c1-3-5-10-8-11(17-16-10)15-12(18)13(4-2)6-7-14-9-13/h8,14H,3-7,9H2,1-2H3,(H2,15,16,17,18)
InChIKeyMLUQAXJSZQQPLK-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.69
Rot. Bonds5

About 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide

3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide (PubChem CID 113433541) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide
PubChem CID113433541
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide
SMILESCCCc1cc(NC(=O)C2(CC)CCNC2)n[nH]1
InChIInChI=1S/C13H22N4O/c1-3-5-10-8-11(17-16-10)15-12(18)13(4-2)6-7-14-9-13/h8,14H,3-7,9H2,1-2H3,(H2,15,16,17,18)
InChIKeyMLUQAXJSZQQPLK-UHFFFAOYSA-N
XLogP1.69
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,4-N-bis(5-propyl-1H-pyrazol-3-yl)bicyclo[2.2.2]octane-1,4-dicarboxamide
CID 166234540
N-(5-ethyl-1H-pyrazol-3-yl)-4-methylpiperidine-4-carboxamide
CID 104618097
1-[2-oxo-2-[(5-propyl-1H-pyrazol-3-yl)amino]ethyl]cyclopentane-1-carboxylic acid
CID 104617311
N-(5-bromo-4-methyl-2-pyridinyl)-3-ethylpyrrolidine-3-carboxamide
CID 79734509
2-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide
CID 104618255
3-ethyl-N-(4-propylphenyl)pyrrolidine-3-carboxamide
CID 55166292
2-(1-aminocyclopentyl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 113433565
2-(1-hydroxycyclohexyl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 111538367
N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide
CID 104619647
N-(5-propyl-1H-pyrazol-3-yl)cyclopropanecarboxamide
CID 115619791
3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propanoic acid
CID 104621777
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-ethylpyrrolidine-3-carboxamide
CID 113433636

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide (CID 113433541) is 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide is CCCc1cc(NC(=O)C2(CC)CCNC2)n[nH]1.
What is the InChIKey of 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide?
The InChIKey is MLUQAXJSZQQPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-3-5-10-8-11(17-16-10)15-12(18)13(4-2)6-7-14-9-13/h8,14H,3-7,9H2,1-2H3,(H2,15,16,17,18).
What are the key properties of 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide?
3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 1.69, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 113433541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).