N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide

C15H22N4O2 — CID 121279557

IUPACN-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide
SMILESCC(C)n1cnc(C(=O)N2CCC(NC(=O)C3CC3)C2)c1
InChIInChI=1S/C15H22N4O2/c1-10(2)19-8-13(16-9-19)15(21)18-6-5-12(7-18)17-14(20)11-3-4-11/h8-12H,3-7H2,1-2H3,(H,17,20)
InChIKeyKJIYDGWGFFUQNB-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.20
Rot. Bonds4

About N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide

N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide (PubChem CID 121279557) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide
PubChem CID121279557
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide
SMILESCC(C)n1cnc(C(=O)N2CCC(NC(=O)C3CC3)C2)c1
InChIInChI=1S/C15H22N4O2/c1-10(2)19-8-13(16-9-19)15(21)18-6-5-12(7-18)17-14(20)11-3-4-11/h8-12H,3-7H2,1-2H3,(H,17,20)
InChIKeyKJIYDGWGFFUQNB-UHFFFAOYSA-N
XLogP1.20
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide (CID 121279557) is N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide is CC(C)n1cnc(C(=O)N2CCC(NC(=O)C3CC3)C2)c1.
What is the InChIKey of N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide?
The InChIKey is KJIYDGWGFFUQNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-10(2)19-8-13(16-9-19)15(21)18-6-5-12(7-18)17-14(20)11-3-4-11/h8-12H,3-7H2,1-2H3,(H,17,20).
What are the key properties of N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide?
N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide has a molecular weight of 290.37 g/mol, XLogP of 1.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-propan-2-ylimidazole-4-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 121279557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).