cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone

C11H19NO — CID 130610084

IUPACcyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone
SMILESC[C@@H]1CCC[C@@H](C)N1C(=O)C1CC1
InChIInChI=1S/C11H19NO/c1-8-4-3-5-9(2)12(8)11(13)10-6-7-10/h8-10H,3-7H2,1-2H3/t8-,9-/m1/s1
InChIKeyTTZNUOMJGVNLIY-RKDXNWHRSA-N
MW181.28 g/mol
LogP2.19
Rot. Bonds1

About cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone

cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone (PubChem CID 130610084) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone
PubChem CID130610084
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Namecyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone
SMILESC[C@@H]1CCC[C@@H](C)N1C(=O)C1CC1
InChIInChI=1S/C11H19NO/c1-8-4-3-5-9(2)12(8)11(13)10-6-7-10/h8-10H,3-7H2,1-2H3/t8-,9-/m1/s1
InChIKeyTTZNUOMJGVNLIY-RKDXNWHRSA-N
XLogP2.19
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2,6-dimethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63782781
cyclohexyl-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanone
CID 897689
1-[4-(2,6-dimethylpiperidine-1-carbonyl)piperidin-1-yl]-2,2,2-trifluoroethanone
CID 110755890
(2,6-dimethylpiperidin-1-yl)-piperidin-3-ylmethanone
CID 18072139
[(2R,6S)-2,6-dimethylpiperidin-1-yl]-[(1S,3R)-3-(trifluoromethyl)cyclohexyl]methanone
CID 124504890
1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]propan-1-one
CID 103715004
cis-(1R,2S)-2-[(2R,6S)-2,6-dimethylpiperidine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 124523302
2-(2,6-dimethylpiperidine-1-carbonyl)cyclopropane-1-carboxylic acid
CID 60791393
(2-aminocyclopentyl)-(2,6-dimethylpiperidin-1-yl)methanone
CID 64816010
(2,6-dimethylpiperidin-1-yl)-(1-methylsulfonylpiperidin-3-yl)methanone
CID 110700207
(2S,3S)-3-[(2R,6S)-2,6-dimethylpiperidine-1-carbonyl]bicyclo[2.2.2]octane-2-carboxylic acid
CID 124723449
2,2-dichloro-1-(2,6-dimethylpiperidin-1-yl)ethanone
CID 3699318

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone (CID 130610084) is cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone is C[C@@H]1CCC[C@@H](C)N1C(=O)C1CC1.
What is the InChIKey of cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone?
The InChIKey is TTZNUOMJGVNLIY-RKDXNWHRSA-N. The full InChI is InChI=1S/C11H19NO/c1-8-4-3-5-9(2)12(8)11(13)10-6-7-10/h8-10H,3-7H2,1-2H3/t8-,9-/m1/s1.
What are the key properties of cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone?
cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone has a molecular weight of 181.28 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone is sourced from PubChem (CID 130610084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).