bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride

C18H35ClN2O2 — CID 137463991

IUPACbis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride
SMILESCC1(C)CC(=O)CC(C)(C)N1.CC1(C)CC(=O)CC(C)(C)N1.Cl
InChIInChI=1S/2C9H17NO.ClH/c2*1-8(2)5-7(11)6-9(3,4)10-8;/h2*10H,5-6H2,1-4H3;1H
InChIKeyJIHMIVBVNTXFSW-UHFFFAOYSA-N
MW346.94 g/mol
LogP3.41
Rot. Bonds

About bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride

bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride (PubChem CID 137463991) has the molecular formula C18H35ClN2O2 and a molecular weight of 346.94 g/mol. Its IUPAC name is bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride.

Molecular Properties

Compound Namebis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride
PubChem CID137463991
Molecular FormulaC18H35ClN2O2
Molecular Weight346.94 g/mol
Exact Mass346.24
IUPAC Namebis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride
SMILESCC1(C)CC(=O)CC(C)(C)N1.CC1(C)CC(=O)CC(C)(C)N1.Cl
InChIInChI=1S/2C9H17NO.ClH/c2*1-8(2)5-7(11)6-9(3,4)10-8;/h2*10H,5-6H2,1-4H3;1H
InChIKeyJIHMIVBVNTXFSW-UHFFFAOYSA-N
XLogP3.41
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.94
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

nitro nitrate;2,2,6,6-tetramethylpiperidin-4-one
CID 174719874
2,2-dimethyl-1-azaspiro[5.5]undecan-4-one
CID 14961667
1,5-dimethyl-8-azabicyclo[3.2.1]octan-3-one
CID 13449492
bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;2,2,6,6-tetramethylpiperidin-4-one
CID 137378199
1,5-dimethyl-6-oxabicyclo[3.1.0]hexan-3-one
CID 101489158
2,2,6,6-tetramethyl-4-methylidenepiperidine
CID 58850535
N-dodecyl-2,2,6,6-tetramethylpiperidin-4-amine;2,2,6,6-tetramethylpiperidin-4-one
CID 159184325
2-[2-[(4E)-4-(methoxymethylidene)-2,6,6-trimethylpiperidin-2-yl]ethyl]-2,6,6-trimethylpiperidin-4-one
CID 164869615
1,5,7-trimethyl-9-azabicyclo[3.3.1]nonan-3-one
CID 71364829
deuterioethane;5,5-dimethyl-3-methylidene-1-prop-1-en-2-ylpyrrolidin-2-one;bis(5,5-dimethyl-3-methylidenepyrrolidin-2-one);2,2,6,6-tetramethylpiperidin-4-one;hydrochloride
CID 160726333
3-fluoro-2,2,6,6-tetramethylpiperidin-4-one
CID 139536839
(6R,8R,11R)-2,2,11-trimethyl-8-prop-1-en-2-yl-1-azaspiro[5.5]undecan-4-one
CID 11747033

Frequently Asked Questions

What is the IUPAC name of bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride?
The IUPAC name of bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride (CID 137463991) is bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride.
What is the SMILES notation for bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride?
The canonical SMILES for bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride is CC1(C)CC(=O)CC(C)(C)N1.CC1(C)CC(=O)CC(C)(C)N1.Cl.
What is the InChIKey of bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride?
The InChIKey is JIHMIVBVNTXFSW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H17NO.ClH/c2*1-8(2)5-7(11)6-9(3,4)10-8;/h2*10H,5-6H2,1-4H3;1H.
What are the key properties of bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride?
bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride has a molecular weight of 346.94 g/mol, XLogP of 3.41, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride is sourced from PubChem (CID 137463991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).