N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide

C22H32N4O2 — CID 53098546

IUPACN-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide
SMILESCc1ccc(CN2CCN(C3CCN(C(=O)NC4CCCC4)CC3)C2=O)cc1
InChIInChI=1S/C22H32N4O2/c1-17-6-8-18(9-7-17)16-25-14-15-26(22(25)28)20-10-12-24(13-11-20)21(27)23-19-4-2-3-5-19/h6-9,19-20H,2-5,10-16H2,1H3,(H,23,27)
InChIKeyWJEVKSQWAXXZJI-UHFFFAOYSA-N
MW384.52 g/mol
LogP3.35
Rot. Bonds4

About N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide

N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide (PubChem CID 53098546) has the molecular formula C22H32N4O2 and a molecular weight of 384.52 g/mol. Its IUPAC name is N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide
PubChem CID53098546
Molecular FormulaC22H32N4O2
Molecular Weight384.52 g/mol
Exact Mass384.25
IUPAC NameN-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide
SMILESCc1ccc(CN2CCN(C3CCN(C(=O)NC4CCCC4)CC3)C2=O)cc1
InChIInChI=1S/C22H32N4O2/c1-17-6-8-18(9-7-17)16-25-14-15-26(22(25)28)20-10-12-24(13-11-20)21(27)23-19-4-2-3-5-19/h6-9,19-20H,2-5,10-16H2,1H3,(H,23,27)
InChIKeyWJEVKSQWAXXZJI-UHFFFAOYSA-N
XLogP3.35
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.52
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide (CID 53098546) is N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide is Cc1ccc(CN2CCN(C3CCN(C(=O)NC4CCCC4)CC3)C2=O)cc1.
What is the InChIKey of N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide?
The InChIKey is WJEVKSQWAXXZJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N4O2/c1-17-6-8-18(9-7-17)16-25-14-15-26(22(25)28)20-10-12-24(13-11-20)21(27)23-19-4-2-3-5-19/h6-9,19-20H,2-5,10-16H2,1H3,(H,23,27).
What are the key properties of N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide?
N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide has a molecular weight of 384.52 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide is sourced from PubChem (CID 53098546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).