(2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone

C15H19ClN2O2 — CID 97449217

IUPAC(2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone
SMILESO=C(c1ccccc1Cl)N1CCOC2(CCNCC2)C1
InChIInChI=1S/C15H19ClN2O2/c16-13-4-2-1-3-12(13)14(19)18-9-10-20-15(11-18)5-7-17-8-6-15/h1-4,17H,5-11H2
InChIKeyFBJVFGBWSGTBQV-UHFFFAOYSA-N
MW294.78 g/mol
LogP1.93
Rot. Bonds1

About (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone

(2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone (PubChem CID 97449217) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone
PubChem CID97449217
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC Name(2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone
SMILESO=C(c1ccccc1Cl)N1CCOC2(CCNCC2)C1
InChIInChI=1S/C15H19ClN2O2/c16-13-4-2-1-3-12(13)14(19)18-9-10-20-15(11-18)5-7-17-8-6-15/h1-4,17H,5-11H2
InChIKeyFBJVFGBWSGTBQV-UHFFFAOYSA-N
XLogP1.93
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chloro-2-fluorophenyl)-[(6S)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone
CID 95726443
(2-chlorophenyl)-(2,7-diazaspiro[4.4]nonan-2-yl)methanone
CID 82038205
(2-chloro-4-indazol-1-ylphenyl)-(6-oxa-2,9-diazaspiro[4.5]decan-9-yl)methanone
CID 167968837
(2-chlorophenyl)-(1,4-diazepan-1-yl)methanone
CID 16777333
(3-chloro-2-hydroxy-5-phenylphenyl)-(1,9-dioxa-4-azaspiro[5.5]undecan-4-yl)methanone
CID 154742242
6-chloro-3-(6-oxa-2,9-diazaspiro[4.5]decane-9-carbonyl)chromen-2-one
CID 171912685
(2-chlorophenyl)-[(6S,9R,10S)-9-(4-fluorophenyl)-10-propan-2-yl-1,8-dioxa-4-azaspiro[5.5]undecan-4-yl]methanone
CID 110154827
N-(2-tert-butylphenyl)-1-oxa-4,9-diazaspiro[5.5]undecane-4-carboxamide
CID 172894919
(4-chloro-2-hydroxyphenyl)-(6-oxa-9-azaspiro[4.5]decan-9-yl)methanone
CID 90648268
(2-methyl-1,3-thiazol-4-yl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone;hydrochloride
CID 67291637
8-(2-chlorobenzoyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 110668800
1-oxa-4,9-diazaspiro[5.5]undecan-4-yl-[3-(pyrrolidin-3-ylmethyl)phenyl]methanone;dihydrochloride
CID 171325750

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone?
The IUPAC name of (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone (CID 97449217) is (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone.
What is the SMILES notation for (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone?
The canonical SMILES for (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone is O=C(c1ccccc1Cl)N1CCOC2(CCNCC2)C1.
What is the InChIKey of (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone?
The InChIKey is FBJVFGBWSGTBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c16-13-4-2-1-3-12(13)14(19)18-9-10-20-15(11-18)5-7-17-8-6-15/h1-4,17H,5-11H2.
What are the key properties of (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone?
(2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone has a molecular weight of 294.78 g/mol, XLogP of 1.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)methanone is sourced from PubChem (CID 97449217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).