N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide

C14H24N4O — CID 110203825

IUPACN-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide
SMILESCCNC(=O)N1CCC(c2ncc(C)n2C(C)C)C1
InChIInChI=1S/C14H24N4O/c1-5-15-14(19)17-7-6-12(9-17)13-16-8-11(4)18(13)10(2)3/h8,10,12H,5-7,9H2,1-4H3,(H,15,19)
InChIKeyROZAHPDFBRSRIK-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.29
Rot. Bonds3

About N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide

N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide (PubChem CID 110203825) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide
PubChem CID110203825
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide
SMILESCCNC(=O)N1CCC(c2ncc(C)n2C(C)C)C1
InChIInChI=1S/C14H24N4O/c1-5-15-14(19)17-7-6-12(9-17)13-16-8-11(4)18(13)10(2)3/h8,10,12H,5-7,9H2,1-4H3,(H,15,19)
InChIKeyROZAHPDFBRSRIK-UHFFFAOYSA-N
XLogP2.29
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide (CID 110203825) is N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide is CCNC(=O)N1CCC(c2ncc(C)n2C(C)C)C1.
What is the InChIKey of N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide?
The InChIKey is ROZAHPDFBRSRIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-5-15-14(19)17-7-6-12(9-17)13-16-8-11(4)18(13)10(2)3/h8,10,12H,5-7,9H2,1-4H3,(H,15,19).
What are the key properties of N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide?
N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(5-methyl-1-propan-2-ylimidazol-2-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 110203825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).