5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine

C12H24N2 — CID 15165793

IUPAC5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine
SMILESCC1(C)CCC(CN2CCCC2)NC1
InChIInChI=1S/C12H24N2/c1-12(2)6-5-11(13-10-12)9-14-7-3-4-8-14/h11,13H,3-10H2,1-2H3
InChIKeyGRHXCKLKUOCDLT-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.86
Rot. Bonds2

About 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine

5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine (PubChem CID 15165793) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine.

Molecular Properties

Compound Name5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine
PubChem CID15165793
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine
SMILESCC1(C)CCC(CN2CCCC2)NC1
InChIInChI=1S/C12H24N2/c1-12(2)6-5-11(13-10-12)9-14-7-3-4-8-14/h11,13H,3-10H2,1-2H3
InChIKeyGRHXCKLKUOCDLT-UHFFFAOYSA-N
XLogP1.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aziridin-2-ylmethyl)piperidine
CID 21193250
ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine
CID 143192100
(2R)-5,5-dimethyl-2-prop-2-enylpiperidine
CID 11321066
1-[(4,4-difluoropyrrolidin-2-yl)methyl]piperidine
CID 167996550
2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]azepane
CID 107393237
3,3-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine
CID 15165790
7,7-dimethyl-4-(pyrrolidin-2-ylmethyl)-1,4-thiazepane
CID 107455301
7,7-dimethyl-4-(piperidin-2-ylmethyl)-1,4-thiazepane
CID 107455308
4-(azetidin-2-ylmethyl)-1,4-thiazepane
CID 131023163
4-methyl-1-[[(2S)-piperidin-2-yl]methyl]piperidine
CID 7141723
1-(pyrrolidin-2-ylmethyl)piperazine
CID 53406264
1-(azepan-2-ylmethyl)-4-methylazepane
CID 64570778

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine?
The IUPAC name of 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine (CID 15165793) is 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine.
What is the SMILES notation for 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine?
The canonical SMILES for 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine is CC1(C)CCC(CN2CCCC2)NC1.
What is the InChIKey of 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine?
The InChIKey is GRHXCKLKUOCDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-12(2)6-5-11(13-10-12)9-14-7-3-4-8-14/h11,13H,3-10H2,1-2H3.
What are the key properties of 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine?
5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine has a molecular weight of 196.34 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine is sourced from PubChem (CID 15165793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).