(3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone

C14H26N2O2 — CID 114084330

IUPAC(3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
SMILESCC1(C)CCCNC1C(=O)N1CCC(CCO)C1
InChIInChI=1S/C14H26N2O2/c1-14(2)6-3-7-15-12(14)13(18)16-8-4-11(10-16)5-9-17/h11-12,15,17H,3-10H2,1-2H3
InChIKeyDXTWEIHTKOSBNZ-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.00
Rot. Bonds3

About (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone

(3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone (PubChem CID 114084330) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
PubChem CID114084330
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
SMILESCC1(C)CCCNC1C(=O)N1CCC(CCO)C1
InChIInChI=1S/C14H26N2O2/c1-14(2)6-3-7-15-12(14)13(18)16-8-4-11(10-16)5-9-17/h11-12,15,17H,3-10H2,1-2H3
InChIKeyDXTWEIHTKOSBNZ-UHFFFAOYSA-N
XLogP1.00
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3,3-dimethylpiperidin-2-yl)-(2-methylmorpholin-4-yl)methanone
CID 114083990
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-piperidin-3-ylmethanone
CID 114797503
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(4-hydroxypyrrolidin-2-yl)methanone
CID 114797528
(3,3-dimethylpiperidin-2-yl)-[2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 114084147
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-[5-(trifluoromethyl)piperidin-2-yl]methanone
CID 114909036
2-[3-(2-hydroxyethyl)pyrrolidine-1-carbonyl]cyclopentane-1-carboxylic acid
CID 114797273
7-bicyclo[4.1.0]heptanyl-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 113340532
(3,3-dimethylpiperidin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
CID 114084054
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(4-methylcyclohexyl)methanone
CID 115775330
1-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-3-piperidin-2-ylpropan-1-one
CID 114797531
1-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-2-methyl-2-piperidin-3-ylpropan-1-one
CID 114797524
1-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-3-methylbut-2-en-1-one
CID 115746427

Frequently Asked Questions

What is the IUPAC name of (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone?
The IUPAC name of (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone (CID 114084330) is (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone?
The canonical SMILES for (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone is CC1(C)CCCNC1C(=O)N1CCC(CCO)C1.
What is the InChIKey of (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone?
The InChIKey is DXTWEIHTKOSBNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-14(2)6-3-7-15-12(14)13(18)16-8-4-11(10-16)5-9-17/h11-12,15,17H,3-10H2,1-2H3.
What are the key properties of (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone?
(3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone has a molecular weight of 254.37 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethylpiperidin-2-yl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 114084330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).