3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide

C14H22N4O — CID 110198068

IUPAC3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide
SMILESCNC(=O)N1CCC(Cc2ncc(C)n2C2CC2)C1
InChIInChI=1S/C14H22N4O/c1-10-8-16-13(18(10)12-3-4-12)7-11-5-6-17(9-11)14(19)15-2/h8,11-12H,3-7,9H2,1-2H3,(H,15,19)
InChIKeyDSQOYVDJQMJJAO-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.73
Rot. Bonds3

About 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide

3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide (PubChem CID 110198068) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide
PubChem CID110198068
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide
SMILESCNC(=O)N1CCC(Cc2ncc(C)n2C2CC2)C1
InChIInChI=1S/C14H22N4O/c1-10-8-16-13(18(10)12-3-4-12)7-11-5-6-17(9-11)14(19)15-2/h8,11-12H,3-7,9H2,1-2H3,(H,15,19)
InChIKeyDSQOYVDJQMJJAO-UHFFFAOYSA-N
XLogP1.73
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(5-Methylimidazol-1-yl)but-2-ynyl]imidazolidin-2-one
CID 15065576
N-[2-(1-isopropyl-5-methyl-1H-imidazol-2-yl)ethyl]-N'-propylurea
CID 91923975
7-ethyl-N,3-dimethylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-carboxamide
CID 97407000
N,3,7-trimethylspiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-carboxamide
CID 97440498
3-cyclopropyl-N-propan-2-ylspiro[5,6-dihydropyrrolo[1,2-a]imidazole-7,4'-piperidine]-1'-carboxamide
CID 97523394
3-cyclopropyl-N-ethylspiro[5,6-dihydropyrrolo[1,2-a]imidazole-7,4'-piperidine]-1'-carboxamide
CID 97523395
4-(2-Cyclopropyl-5-methyl-1H-imidazol-1-YL)-N,N-dimethylpiperidine-1-carboxamide
CID 110198117
N-[2-(1-cyclopentyl-5-methyl-1H-imidazol-2-yl)ethyl]acetamide
CID 110203798
N-[2-(2-cyclopropyl-5-methyl-1H-imidazol-1-yl)ethyl]-2-methylpropanamide
CID 124048746
4-[(2-cyclopropyl-5-methyl-1H-imidazol-1-yl)methyl]piperidine
CID 90488066
1-[3-[[1-(Cyclopropylmethyl)-5-methylimidazol-2-yl]methyl]pyrrolidin-1-yl]ethanone
CID 110198069
Cyclopropyl-[3-[[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]methyl]pyrrolidin-1-yl]methanone
CID 124046107

Frequently Asked Questions

What is the IUPAC name of 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide?
The IUPAC name of 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide (CID 110198068) is 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide.
What is the SMILES notation for 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide?
The canonical SMILES for 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide is CNC(=O)N1CCC(Cc2ncc(C)n2C2CC2)C1.
What is the InChIKey of 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide?
The InChIKey is DSQOYVDJQMJJAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-8-16-13(18(10)12-3-4-12)7-11-5-6-17(9-11)14(19)15-2/h8,11-12H,3-7,9H2,1-2H3,(H,15,19).
What are the key properties of 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide?
3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-cyclopropyl-5-methylimidazol-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide is sourced from PubChem (CID 110198068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).