(2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride

C14H27ClN2O — CID 119338501

IUPAC(2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride
SMILESC[C@@H](N)C(=O)N1CCCC2(CCCCCC2)C1.Cl
InChIInChI=1S/C14H26N2O.ClH/c1-12(15)13(17)16-10-6-9-14(11-16)7-4-2-3-5-8-14;/h12H,2-11,15H2,1H3;1H/t12-;/m1./s1
InChIKeyULRAEQMEZCDZSV-UTONKHPSSA-N
MW274.84 g/mol
LogP2.72
Rot. Bonds1

About (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride

(2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride (PubChem CID 119338501) has the molecular formula C14H27ClN2O and a molecular weight of 274.84 g/mol. Its IUPAC name is (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride
PubChem CID119338501
Molecular FormulaC14H27ClN2O
Molecular Weight274.84 g/mol
Exact Mass274.18
IUPAC Name(2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride
SMILESC[C@@H](N)C(=O)N1CCCC2(CCCCCC2)C1.Cl
InChIInChI=1S/C14H26N2O.ClH/c1-12(15)13(17)16-10-6-9-14(11-16)7-4-2-3-5-8-14;/h12H,2-11,15H2,1H3;1H/t12-;/m1./s1
InChIKeyULRAEQMEZCDZSV-UTONKHPSSA-N
XLogP2.72
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.84
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-1-(2-azaspiro[4.4]nonan-2-yl)propan-1-one
CID 130163238
(2S)-2-amino-1-(2-azaspiro[5.5]undecan-2-yl)-4-methylpentan-1-one;hydrochloride
CID 119784790
2-amino-1-(2-azaspiro[5.5]undecan-2-yl)-3-methylpentan-1-one;hydrochloride
CID 119784774
2-amino-1-(azetidin-1-yl)propan-1-one;hydrochloride
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(2S)-2-amino-1-(azetidin-1-yl)propan-1-one;hydrochloride
CID 53484456
(3S)-3-amino-1-(2-aminopropanoyl)piperidine-3-carboxylic acid
CID 167074767
(2S)-2-amino-1-(2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one;hydrochloride
CID 130927327
1-(2-azaspiro[4.5]decan-2-yl)-2-chloropropan-1-one
CID 130164939
1-(2-azaspiro[5.5]undecan-2-yl)ethanone
CID 18685206
(2S)-2-amino-1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one
CID 130762944
(2R)-2-amino-1-(3-methyl-3-propylpiperidin-1-yl)propan-1-one;hydrochloride
CID 119328269
2-amino-1-(6-azaspiro[3.4]octan-6-yl)-3-methylbutan-1-one
CID 119326633

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride?
The IUPAC name of (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride (CID 119338501) is (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride.
What is the SMILES notation for (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride?
The canonical SMILES for (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride is C[C@@H](N)C(=O)N1CCCC2(CCCCCC2)C1.Cl.
What is the InChIKey of (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride?
The InChIKey is ULRAEQMEZCDZSV-UTONKHPSSA-N. The full InChI is InChI=1S/C14H26N2O.ClH/c1-12(15)13(17)16-10-6-9-14(11-16)7-4-2-3-5-8-14;/h12H,2-11,15H2,1H3;1H/t12-;/m1./s1.
What are the key properties of (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride?
(2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride has a molecular weight of 274.84 g/mol, XLogP of 2.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1-(2-azaspiro[5.6]dodecan-2-yl)propan-1-one;hydrochloride is sourced from PubChem (CID 119338501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).