3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride

C15H27ClN2O2 — CID 119768999

IUPAC3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride
SMILESCl.O=C(C1CNCCO1)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C15H26N2O2.ClH/c18-14(13-12-16-8-11-19-13)17-9-6-15(7-10-17)4-2-1-3-5-15;/h13,16H,1-12H2;1H
InChIKeyAUKKZUHOSYRZBU-UHFFFAOYSA-N
MW302.85 g/mol
LogP1.97
Rot. Bonds1

About 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride

3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride (PubChem CID 119768999) has the molecular formula C15H27ClN2O2 and a molecular weight of 302.85 g/mol. Its IUPAC name is 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride.

Molecular Properties

Compound Name3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride
PubChem CID119768999
Molecular FormulaC15H27ClN2O2
Molecular Weight302.85 g/mol
Exact Mass302.18
IUPAC Name3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride
SMILESCl.O=C(C1CNCCO1)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C15H26N2O2.ClH/c18-14(13-12-16-8-11-19-13)17-9-6-15(7-10-17)4-2-1-3-5-15;/h13,16H,1-12H2;1H
InChIKeyAUKKZUHOSYRZBU-UHFFFAOYSA-N
XLogP1.97
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.85
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

morpholin-2-yl(piperidin-1-yl)methanone;hydrochloride
CID 71298615
(4,4-diethylpiperidin-1-yl)-morpholin-2-ylmethanone
CID 55160831
morpholin-2-yl-(4-piperidin-1-ylpiperidin-1-yl)methanone;dihydrochloride
CID 119842984
(1,1-dioxo-1,4-thiazepan-4-yl)-morpholin-2-ylmethanone
CID 113266787
2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride
CID 119837297
[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone
CID 107222846
1-methyl-1'-[(2S)-morpholine-2-carbonyl]spiro[indole-3,4'-piperidine]-2-one
CID 95721558
[4-(2-methoxyethyl)piperazin-1-yl]-morpholin-2-ylmethanone;dihydrochloride
CID 119838568
morpholin-2-yl-(4-propyl-1,4-diazepan-1-yl)methanone
CID 131911390
[4-(5-methylthiophene-2-carbonyl)piperazin-1-yl]-morpholin-2-ylmethanone;hydrochloride
CID 119745412
[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-morpholin-2-ylmethanone;hydrochloride
CID 119747817
[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride
CID 154893166

Frequently Asked Questions

What is the IUPAC name of 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride?
The IUPAC name of 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride (CID 119768999) is 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride.
What is the SMILES notation for 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride?
The canonical SMILES for 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride is Cl.O=C(C1CNCCO1)N1CCC2(CCCCC2)CC1.
What is the InChIKey of 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride?
The InChIKey is AUKKZUHOSYRZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2.ClH/c18-14(13-12-16-8-11-19-13)17-9-6-15(7-10-17)4-2-1-3-5-15;/h13,16H,1-12H2;1H.
What are the key properties of 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride?
3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride has a molecular weight of 302.85 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride is sourced from PubChem (CID 119768999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).