(3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone

C11H19N3O — CID 23280978

IUPAC(3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone
SMILESCC(C)N1C=CN(C(=O)N2CCCC2)C1
InChIInChI=1S/C11H19N3O/c1-10(2)13-7-8-14(9-13)11(15)12-5-3-4-6-12/h7-8,10H,3-6,9H2,1-2H3
InChIKeyFIWVHZWBIJXKLO-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.66
Rot. Bonds1

About (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone

(3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone (PubChem CID 23280978) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone
PubChem CID23280978
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name(3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone
SMILESCC(C)N1C=CN(C(=O)N2CCCC2)C1
InChIInChI=1S/C11H19N3O/c1-10(2)13-7-8-14(9-13)11(15)12-5-3-4-6-12/h7-8,10H,3-6,9H2,1-2H3
InChIKeyFIWVHZWBIJXKLO-UHFFFAOYSA-N
XLogP1.66
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dihydro-1-methyl-3-[4-(1-pyrrolidinyl)-2-butynyl]-2H-imidazol-2-one
CID 15065517
1,3-Bis(ethenyl)-4-methylimidazolidin-2-one
CID 10997226
1-Methyl-3-(5-pyrrolidin-1-ylpent-3-yn-2-yl)imidazol-2-one
CID 15065519
N,3-dimethyl-N-propan-2-yl-2H-imidazole-1-carboxamide
CID 22047783
1-Propan-2-yl-3-propylimidazol-2-one
CID 23555511
1-Pentyl-3-propan-2-ylimidazol-2-one
CID 89099528
1-Ethenyl-3-propan-2-ylimidazolidin-2-one
CID 132498347
1-Butyl-3-ethenylimidazolidin-2-one
CID 132498348
(2,3-dimethyl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone
CID 146652310
N,3-dimethyl-N-propan-2-yl-2H-imidazole-1-carboxamide;hydroiodide
CID 174443148
CID 11585945
CID 11585945
CID 25197322
CID 25197322

Frequently Asked Questions

What is the IUPAC name of (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone (CID 23280978) is (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone is CC(C)N1C=CN(C(=O)N2CCCC2)C1.
What is the InChIKey of (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone?
The InChIKey is FIWVHZWBIJXKLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-10(2)13-7-8-14(9-13)11(15)12-5-3-4-6-12/h7-8,10H,3-6,9H2,1-2H3.
What are the key properties of (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone?
(3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone has a molecular weight of 209.29 g/mol, XLogP of 1.66, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-propan-2-yl-2H-imidazol-1-yl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 23280978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).