2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one

C22H30N2O3 — CID 70771950

IUPAC2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one
SMILESO=C(Cc1ccccc1O)N1CCCC2(CCC(=O)N(C3CCCC3)C2)C1
InChIInChI=1S/C22H30N2O3/c25-19-9-4-1-6-17(19)14-21(27)23-13-5-11-22(15-23)12-10-20(26)24(16-22)18-7-2-3-8-18/h1,4,6,9,18,25H,2-3,5,7-8,10-16H2
InChIKeyGUYYOVVJEGSXRK-UHFFFAOYSA-N
MW370.49 g/mol
LogP3.11
Rot. Bonds3

About 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one

2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one (PubChem CID 70771950) has the molecular formula C22H30N2O3 and a molecular weight of 370.49 g/mol. Its IUPAC name is 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one.

Molecular Properties

Compound Name2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one
PubChem CID70771950
Molecular FormulaC22H30N2O3
Molecular Weight370.49 g/mol
Exact Mass370.23
IUPAC Name2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one
SMILESO=C(Cc1ccccc1O)N1CCCC2(CCC(=O)N(C3CCCC3)C2)C1
InChIInChI=1S/C22H30N2O3/c25-19-9-4-1-6-17(19)14-21(27)23-13-5-11-22(15-23)12-10-20(26)24(16-22)18-7-2-3-8-18/h1,4,6,9,18,25H,2-3,5,7-8,10-16H2
InChIKeyGUYYOVVJEGSXRK-UHFFFAOYSA-N
XLogP3.11
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.49
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethyl)-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one
CID 70777892
(6S)-2-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecane-8-carboxamide
CID 97149830
(6S)-2-cyclopropyl-8-(3-ethylsulfanylpropanoyl)-2,8-diazaspiro[5.5]undecan-3-one
CID 97114533
2-cyclopropyl-8-(2-imidazol-1-ylacetyl)-2,8-diazaspiro[5.5]undecan-3-one
CID 70754239
(6S)-2-cyclopropyl-8-[2-(6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one
CID 98301776
2-[2-(2-hydroxyphenyl)acetyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82863455
2-cyclopropyl-8-[2-[methyl(pyridin-4-ylmethyl)amino]acetyl]-2,8-diazaspiro[5.5]undecan-3-one
CID 72866096
2-cyclopentyl-8-(2-methyl-6-oxo-1H-pyrimidine-5-carbonyl)-2,8-diazaspiro[5.5]undecan-3-one
CID 70724597
(6S)-2-cyclopropyl-8-(1,1-dioxothiane-4-carbonyl)-2,8-diazaspiro[5.5]undecan-3-one
CID 97142136
2-cyclopentyl-9-(4-hydroxybenzoyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72853987
2-cyclopropyl-8-(1,1-dioxothiane-4-carbonyl)-2,8-diazaspiro[5.5]undecan-3-one
CID 72909555
2-(2-cyclopentyl-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl)pyridine-3-carboxylic acid
CID 70761968

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one?
The IUPAC name of 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one (CID 70771950) is 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one.
What is the SMILES notation for 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one?
The canonical SMILES for 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one is O=C(Cc1ccccc1O)N1CCCC2(CCC(=O)N(C3CCCC3)C2)C1.
What is the InChIKey of 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one?
The InChIKey is GUYYOVVJEGSXRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O3/c25-19-9-4-1-6-17(19)14-21(27)23-13-5-11-22(15-23)12-10-20(26)24(16-22)18-7-2-3-8-18/h1,4,6,9,18,25H,2-3,5,7-8,10-16H2.
What are the key properties of 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one?
2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one has a molecular weight of 370.49 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-8-[2-(2-hydroxyphenyl)acetyl]-2,8-diazaspiro[5.5]undecan-3-one is sourced from PubChem (CID 70771950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).