cyclopropyl 4,4-dimethylpiperidine-1-carboxylate

C11H19NO2 — CID 165444759

IUPACcyclopropyl 4,4-dimethylpiperidine-1-carboxylate
SMILESCC1(C)CCN(C(=O)OC2CC2)CC1
InChIInChI=1S/C11H19NO2/c1-11(2)5-7-12(8-6-11)10(13)14-9-3-4-9/h9H,3-8H2,1-2H3
InChIKeyCYKYLLJHDYYLTC-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.41
Rot. Bonds1

About cyclopropyl 4,4-dimethylpiperidine-1-carboxylate

cyclopropyl 4,4-dimethylpiperidine-1-carboxylate (PubChem CID 165444759) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is cyclopropyl 4,4-dimethylpiperidine-1-carboxylate.

Molecular Properties

Compound Namecyclopropyl 4,4-dimethylpiperidine-1-carboxylate
PubChem CID165444759
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Namecyclopropyl 4,4-dimethylpiperidine-1-carboxylate
SMILESCC1(C)CCN(C(=O)OC2CC2)CC1
InChIInChI=1S/C11H19NO2/c1-11(2)5-7-12(8-6-11)10(13)14-9-3-4-9/h9H,3-8H2,1-2H3
InChIKeyCYKYLLJHDYYLTC-UHFFFAOYSA-N
XLogP2.41
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

azetidin-3-yl 3,3-dimethylpyrrolidine-1-carboxylate
CID 118447065
cyclobutyl 4-methylpiperazine-1-carboxylate
CID 131024600
4-O-tert-butyl 1-O-(4,4-difluorocyclohexyl) piperazine-1,4-dicarboxylate
CID 174244942
tert-butyl 4,4-dimethylazepane-1-carboxylate
CID 65286456
(1-methylcycloundecyl) 4,4-dimethylazepane-1-carboxylate
CID 155468911
1-(4,4-dimethylpiperidin-1-yl)ethanone;propane
CID 166079085
ethane;methyl 3,3-dimethylpyrrolidine-1-carboxylate
CID 144942251
2-hydroxyethyl 4,4-dimethylazepane-1-carboxylate
CID 79349080
azetidin-3-yl 4-methylpiperidine-1-carboxylate
CID 79337031
ethyl 4-tert-butyl-4-methylpiperidine-1-carboxylate
CID 70795313
[5-[4-[(4-amino-1-methylcyclohexyl)carbamoyloxy]piperazine-1-carbonyl]oxycyclooctyl] 4-[(4-amino-1-methylcyclohexyl)carbamoyloxy]piperazine-1-carboxylate
CID 54243068
[4-(iodoamino)cyclohexyl] piperazine-1-carboxylate
CID 88963460

Frequently Asked Questions

What is the IUPAC name of cyclopropyl 4,4-dimethylpiperidine-1-carboxylate?
The IUPAC name of cyclopropyl 4,4-dimethylpiperidine-1-carboxylate (CID 165444759) is cyclopropyl 4,4-dimethylpiperidine-1-carboxylate.
What is the SMILES notation for cyclopropyl 4,4-dimethylpiperidine-1-carboxylate?
The canonical SMILES for cyclopropyl 4,4-dimethylpiperidine-1-carboxylate is CC1(C)CCN(C(=O)OC2CC2)CC1.
What is the InChIKey of cyclopropyl 4,4-dimethylpiperidine-1-carboxylate?
The InChIKey is CYKYLLJHDYYLTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-11(2)5-7-12(8-6-11)10(13)14-9-3-4-9/h9H,3-8H2,1-2H3.
What are the key properties of cyclopropyl 4,4-dimethylpiperidine-1-carboxylate?
cyclopropyl 4,4-dimethylpiperidine-1-carboxylate has a molecular weight of 197.28 g/mol, XLogP of 2.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl 4,4-dimethylpiperidine-1-carboxylate is sourced from PubChem (CID 165444759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).