1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one

C18H27N3O2 — CID 95590514

IUPAC1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one
SMILESCC(C)Oc1ccccc1CN1CCC[C@@H](N2CCNC2=O)C1
InChIInChI=1S/C18H27N3O2/c1-14(2)23-17-8-4-3-6-15(17)12-20-10-5-7-16(13-20)21-11-9-19-18(21)22/h3-4,6,8,14,16H,5,7,9-13H2,1-2H3,(H,19,22)/t16-/m1/s1
InChIKeyHGDRIJZDJTZGEY-MRXNPFEDSA-N
MW317.43 g/mol
LogP2.46
Rot. Bonds5

About 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one

1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one (PubChem CID 95590514) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one
PubChem CID95590514
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC Name1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one
SMILESCC(C)Oc1ccccc1CN1CCC[C@@H](N2CCNC2=O)C1
InChIInChI=1S/C18H27N3O2/c1-14(2)23-17-8-4-3-6-15(17)12-20-10-5-7-16(13-20)21-11-9-19-18(21)22/h3-4,6,8,14,16H,5,7,9-13H2,1-2H3,(H,19,22)/t16-/m1/s1
InChIKeyHGDRIJZDJTZGEY-MRXNPFEDSA-N
XLogP2.46
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one with MolForge

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Related Compounds

1-(1-benzylpiperidin-3-yl)imidazolidin-2-one
CID 78980069
1-[(3S)-1-[(2-nitrophenyl)methyl]piperidin-3-yl]imidazolidin-2-one
CID 94792411
1-[(2-propan-2-yloxyphenyl)methyl]piperidine-3-carboxylic acid
CID 54848340
N-[[(3S)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]methyl]acetamide
CID 95187363
1-[(3R)-1-(2-phenylsulfanylethyl)piperidin-3-yl]imidazolidin-2-one
CID 95771278
1-[(3R)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]imidazolidin-2-one
CID 95151332
1-[(2-propan-2-yloxyphenyl)methyl]pyrrolidine-3-carboxylic acid
CID 119904478
1-[(3R)-1-(1,3-benzothiazol-2-ylmethyl)piperidin-3-yl]imidazolidin-2-one
CID 95585798
1-[1-[(2-propan-2-yloxyphenyl)methyl]piperidin-4-yl]ethanol
CID 111113750
(3R)-3-[4-[(2-propan-2-yloxyphenyl)methyl]piperazin-1-yl]thiolane 1,1-dioxide
CID 97085497
(3R)-3-(2-oxoimidazolidin-1-yl)-N-(4-propan-2-yloxyphenyl)piperidine-1-carboxamide
CID 97262496
1-[1-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]piperidin-3-yl]imidazolidin-2-one
CID 56799959

Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one?
The IUPAC name of 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one (CID 95590514) is 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one?
The canonical SMILES for 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one is CC(C)Oc1ccccc1CN1CCC[C@@H](N2CCNC2=O)C1.
What is the InChIKey of 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one?
The InChIKey is HGDRIJZDJTZGEY-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-14(2)23-17-8-4-3-6-15(17)12-20-10-5-7-16(13-20)21-11-9-19-18(21)22/h3-4,6,8,14,16H,5,7,9-13H2,1-2H3,(H,19,22)/t16-/m1/s1.
What are the key properties of 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one?
1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one has a molecular weight of 317.43 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-1-[(2-propan-2-yloxyphenyl)methyl]piperidin-3-yl]imidazolidin-2-one is sourced from PubChem (CID 95590514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).