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

C14H23N5O2 — CID 70768201

IUPAC1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide
SMILESCC(C)Cc1cc(C(=O)NCCN2CCNC2=O)n(C)n1
InChIInChI=1S/C14H23N5O2/c1-10(2)8-11-9-12(18(3)17-11)13(20)15-4-6-19-7-5-16-14(19)21/h9-10H,4-8H2,1-3H3,(H,15,20)(H,16,21)
InChIKeyVULHYIJRQSYHPQ-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.37
Rot. Bonds6

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

1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide (PubChem CID 70768201) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide.

Molecular Properties

Compound Name1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide
PubChem CID70768201
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide
SMILESCC(C)Cc1cc(C(=O)NCCN2CCNC2=O)n(C)n1
InChIInChI=1S/C14H23N5O2/c1-10(2)8-11-9-12(18(3)17-11)13(20)15-4-6-19-7-5-16-14(19)21/h9-10H,4-8H2,1-3H3,(H,15,20)(H,16,21)
InChIKeyVULHYIJRQSYHPQ-UHFFFAOYSA-N
XLogP0.37
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide?
The IUPAC name of 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide (CID 70768201) is 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide.
What is the SMILES notation for 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide?
The canonical SMILES for 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide is CC(C)Cc1cc(C(=O)NCCN2CCNC2=O)n(C)n1.
What is the InChIKey of 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide?
The InChIKey is VULHYIJRQSYHPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-10(2)8-11-9-12(18(3)17-11)13(20)15-4-6-19-7-5-16-14(19)21/h9-10H,4-8H2,1-3H3,(H,15,20)(H,16,21).
What are the key properties of 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide?
1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-methylpropyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrazole-5-carboxamide is sourced from PubChem (CID 70768201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).