1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide

C15H25N5O2 — CID 70738674

IUPAC1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide
SMILESCCn1nc(CC(C)C)cc1C(=O)NCCN1CCNC1=O
InChIInChI=1S/C15H25N5O2/c1-4-20-13(10-12(18-20)9-11(2)3)14(21)16-5-7-19-8-6-17-15(19)22/h10-11H,4-9H2,1-3H3,(H,16,21)(H,17,22)
InChIKeyROHPFSZTTNDERS-UHFFFAOYSA-N
MW307.40 g/mol
LogP0.86
Rot. Bonds7

About 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide

1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide (PubChem CID 70738674) has the molecular formula C15H25N5O2 and a molecular weight of 307.40 g/mol. Its IUPAC name is 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide.

Molecular Properties

Compound Name1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide
PubChem CID70738674
Molecular FormulaC15H25N5O2
Molecular Weight307.40 g/mol
Exact Mass307.20
IUPAC Name1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide
SMILESCCn1nc(CC(C)C)cc1C(=O)NCCN1CCNC1=O
InChIInChI=1S/C15H25N5O2/c1-4-20-13(10-12(18-20)9-11(2)3)14(21)16-5-7-19-8-6-17-15(19)22/h10-11H,4-9H2,1-3H3,(H,16,21)(H,17,22)
InChIKeyROHPFSZTTNDERS-UHFFFAOYSA-N
XLogP0.86
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide?
The IUPAC name of 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide (CID 70738674) is 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide.
What is the SMILES notation for 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide?
The canonical SMILES for 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide is CCn1nc(CC(C)C)cc1C(=O)NCCN1CCNC1=O.
What is the InChIKey of 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide?
The InChIKey is ROHPFSZTTNDERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O2/c1-4-20-13(10-12(18-20)9-11(2)3)14(21)16-5-7-19-8-6-17-15(19)22/h10-11H,4-9H2,1-3H3,(H,16,21)(H,17,22).
What are the key properties of 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide?
1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide has a molecular weight of 307.40 g/mol, XLogP of 0.86, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide is sourced from PubChem (CID 70738674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).