1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide

C15H22N4O2 — CID 104619767

IUPAC1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
SMILESCCCc1cc(NC(=O)C2CCCN2C(=O)C2CC2)n[nH]1
InChIInChI=1S/C15H22N4O2/c1-2-4-11-9-13(18-17-11)16-14(20)12-5-3-8-19(12)15(21)10-6-7-10/h9-10,12H,2-8H2,1H3,(H2,16,17,18,20)
InChIKeyUPDPTGAXVMKUKX-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.70
Rot. Bonds5

About 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide

1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide (PubChem CID 104619767) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
PubChem CID104619767
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
SMILESCCCc1cc(NC(=O)C2CCCN2C(=O)C2CC2)n[nH]1
InChIInChI=1S/C15H22N4O2/c1-2-4-11-9-13(18-17-11)16-14(20)12-5-3-8-19(12)15(21)10-6-7-10/h9-10,12H,2-8H2,1H3,(H2,16,17,18,20)
InChIKeyUPDPTGAXVMKUKX-UHFFFAOYSA-N
XLogP1.70
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide (CID 104619767) is 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide is CCCc1cc(NC(=O)C2CCCN2C(=O)C2CC2)n[nH]1.
What is the InChIKey of 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is UPDPTGAXVMKUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-2-4-11-9-13(18-17-11)16-14(20)12-5-3-8-19(12)15(21)10-6-7-10/h9-10,12H,2-8H2,1H3,(H2,16,17,18,20).
What are the key properties of 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropanecarbonyl)-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 104619767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).