1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride

C11H21ClN2O — CID 130744658

IUPAC1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride
SMILESCCC(=O)N1CCC2(CCNC2)CC1.Cl
InChIInChI=1S/C11H20N2O.ClH/c1-2-10(14)13-7-4-11(5-8-13)3-6-12-9-11;/h12H,2-9H2,1H3;1H
InChIKeyPDDIMYZFSVLLST-UHFFFAOYSA-N
MW232.75 g/mol
LogP1.42
Rot. Bonds1

About 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride

1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride (PubChem CID 130744658) has the molecular formula C11H21ClN2O and a molecular weight of 232.75 g/mol. Its IUPAC name is 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride.

Molecular Properties

Compound Name1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride
PubChem CID130744658
Molecular FormulaC11H21ClN2O
Molecular Weight232.75 g/mol
Exact Mass232.13
IUPAC Name1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride
SMILESCCC(=O)N1CCC2(CCNC2)CC1.Cl
InChIInChI=1S/C11H20N2O.ClH/c1-2-10(14)13-7-4-11(5-8-13)3-6-12-9-11;/h12H,2-9H2,1H3;1H
InChIKeyPDDIMYZFSVLLST-UHFFFAOYSA-N
XLogP1.42
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.75
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2,7-diazaspiro[4.4]nonane-2-carboxamide
CID 130525692
ethyl 2,7-diazaspiro[4.4]nonane-2-carboxylate
CID 82038278
1-(3,9-diazaspiro[5.5]undecan-3-yl)-2-(4-ethylpiperazin-1-yl)ethanone;dihydrochloride
CID 154888181
1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-methylpropan-1-one;hydrochloride
CID 169493333
8-ethyl-2,8-diazaspiro[4.5]decane
CID 46318290
1-(2-sulfanyl-2,7-diazaspiro[3.5]nonan-7-yl)propan-1-one
CID 170184671
1-(2,8-diazaspiro[4.5]decan-8-yl)-2-(1H-pyrrol-2-yl)ethanone
CID 115276479
(2S)-2-amino-1-(2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one;hydrochloride
CID 130927327
cyclobutyl(2,8-diazaspiro[4.5]decan-8-yl)methanone
CID 83708252
1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-(2-methoxyethoxy)ethanone
CID 82038244
1-[4-(3-methylpiperidine-3-carbonyl)-1,4-diazepan-1-yl]propan-1-one
CID 63131526
8-propylsulfonyl-2,8-diazaspiro[4.5]decane;hydrochloride
CID 169490463

Frequently Asked Questions

What is the IUPAC name of 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride?
The IUPAC name of 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride (CID 130744658) is 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride.
What is the SMILES notation for 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride?
The canonical SMILES for 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride is CCC(=O)N1CCC2(CCNC2)CC1.Cl.
What is the InChIKey of 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride?
The InChIKey is PDDIMYZFSVLLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O.ClH/c1-2-10(14)13-7-4-11(5-8-13)3-6-12-9-11;/h12H,2-9H2,1H3;1H.
What are the key properties of 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride?
1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride has a molecular weight of 232.75 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,8-diazaspiro[4.5]decan-8-yl)propan-1-one;hydrochloride is sourced from PubChem (CID 130744658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).