N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide

C17H24N4O2 — CID 118795910

IUPACN-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide
SMILESO=C(NCCN1CCNC1=O)c1ccc(CN2CCCC2)cc1
InChIInChI=1S/C17H24N4O2/c22-16(18-7-11-21-12-8-19-17(21)23)15-5-3-14(4-6-15)13-20-9-1-2-10-20/h3-6H,1-2,7-13H2,(H,18,22)(H,19,23)
InChIKeyOWISJCDKJKWFTC-UHFFFAOYSA-N
MW316.40 g/mol
LogP1.04
Rot. Bonds6

About N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide

N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide (PubChem CID 118795910) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide
PubChem CID118795910
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC NameN-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide
SMILESO=C(NCCN1CCNC1=O)c1ccc(CN2CCCC2)cc1
InChIInChI=1S/C17H24N4O2/c22-16(18-7-11-21-12-8-19-17(21)23)15-5-3-14(4-6-15)13-20-9-1-2-10-20/h3-6H,1-2,7-13H2,(H,18,22)(H,19,23)
InChIKeyOWISJCDKJKWFTC-UHFFFAOYSA-N
XLogP1.04
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3,6-dioxo-1H-pyridazin-2-yl)ethyl]-4-(piperidin-1-ylmethyl)benzamide
CID 50971729
4-(azepan-1-ylmethyl)-N-propylbenzamide
CID 43924202
4-(piperidin-1-ylmethyl)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzamide
CID 24654968
4-(azepan-1-ylmethyl)-N-[3-(2-oxo-1-pyridinyl)propyl]benzamide
CID 90652688
N-[2-(4-chlorophenyl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide
CID 94773934
N-[3-(4-fluorophenyl)propyl]-4-(pyrrolidin-1-ylmethyl)benzamide
CID 46773438
N-[2-[3-(hydroxymethyl)piperidin-1-yl]ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide
CID 74239780
N-[3-(dimethylamino)propyl]-4-(piperidin-1-ylmethyl)benzamide
CID 41455697
4-(piperidin-1-ylmethyl)-N-(pyridin-4-ylmethyl)benzamide
CID 17398321
4-pentyl-N-[2-[4-(pyrrolidin-1-ylmethyl)phenyl]ethyl]benzamide
CID 23090890
4-(4-chlorophenyl)-N-[2-[4-(piperidin-1-ylmethyl)phenyl]ethyl]benzamide
CID 11743571
4-[[(2R,6R)-2,6-dimethylmorpholin-4-yl]methyl]-N-[2-(2-oxoazepan-1-yl)ethyl]benzamide
CID 39515011

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide?
The IUPAC name of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide (CID 118795910) is N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide.
What is the SMILES notation for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide?
The canonical SMILES for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide is O=C(NCCN1CCNC1=O)c1ccc(CN2CCCC2)cc1.
What is the InChIKey of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide?
The InChIKey is OWISJCDKJKWFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c22-16(18-7-11-21-12-8-19-17(21)23)15-5-3-14(4-6-15)13-20-9-1-2-10-20/h3-6H,1-2,7-13H2,(H,18,22)(H,19,23).
What are the key properties of N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide?
N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide has a molecular weight of 316.40 g/mol, XLogP of 1.04, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide is sourced from PubChem (CID 118795910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).