2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide

C17H30N4O — CID 75430879

IUPAC2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide
SMILESCc1nccn1CCCN(C)C(=O)C(C)N1C(C)CCC1C
InChIInChI=1S/C17H30N4O/c1-13-7-8-14(2)21(13)15(3)17(22)19(5)10-6-11-20-12-9-18-16(20)4/h9,12-15H,6-8,10-11H2,1-5H3
InChIKeyYWNSZPATWRJDAF-UHFFFAOYSA-N
MW306.45 g/mol
LogP2.30
Rot. Bonds6

About 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide

2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide (PubChem CID 75430879) has the molecular formula C17H30N4O and a molecular weight of 306.45 g/mol. Its IUPAC name is 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide.

Molecular Properties

Compound Name2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide
PubChem CID75430879
Molecular FormulaC17H30N4O
Molecular Weight306.45 g/mol
Exact Mass306.24
IUPAC Name2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide
SMILESCc1nccn1CCCN(C)C(=O)C(C)N1C(C)CCC1C
InChIInChI=1S/C17H30N4O/c1-13-7-8-14(2)21(13)15(3)17(22)19(5)10-6-11-20-12-9-18-16(20)4/h9,12-15H,6-8,10-11H2,1-5H3
InChIKeyYWNSZPATWRJDAF-UHFFFAOYSA-N
XLogP2.30
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,4S)-N,2-dimethyl-N-[3-(2-methylimidazol-1-yl)propyl]piperidine-4-carboxamide;hydrochloride
CID 120639694
N-[2-[cyclopentyl(methyl)amino]ethyl]-N-methyl-2-(2-methylimidazol-1-yl)propanamide
CID 119058749
2-methyl-1-(5-methylhexyl)imidazole
CID 166170762
1-[4-[(1R)-3,3-difluorocyclopentyl]butyl]-2-methylimidazole
CID 67539225
(2S)-N-[2-(azepan-1-yl)ethyl]-N-methyl-2-(2-methylimidazol-1-yl)propanamide
CID 126432376
2-methyl-1-(4-methylpentyl)imidazole
CID 20811797
N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]-5-sulfamoylthiophene-3-carboxamide
CID 139011734
2-methyl-1-(6-methylheptyl)imidazole
CID 176869626
(2R)-N,N-dimethyl-1-[3-(2-methylimidazol-1-yl)propyl]pyrrolidine-2-carboxamide
CID 97009294
bis(1-decyl-2-methylimidazole);dihydrochloride
CID 173324377
5-(2-methylimidazol-1-yl)-N-propan-2-ylpentanamide
CID 54508862
1-ethyl-1-methyl-3-[4-(2-methylimidazol-1-yl)butyl]urea
CID 71868078

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide?
The IUPAC name of 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide (CID 75430879) is 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide.
What is the SMILES notation for 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide?
The canonical SMILES for 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide is Cc1nccn1CCCN(C)C(=O)C(C)N1C(C)CCC1C.
What is the InChIKey of 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide?
The InChIKey is YWNSZPATWRJDAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O/c1-13-7-8-14(2)21(13)15(3)17(22)19(5)10-6-11-20-12-9-18-16(20)4/h9,12-15H,6-8,10-11H2,1-5H3.
What are the key properties of 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide?
2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide has a molecular weight of 306.45 g/mol, XLogP of 2.30, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-[3-(2-methylimidazol-1-yl)propyl]propanamide is sourced from PubChem (CID 75430879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).