2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone

C12H22N2O2 — CID 64683579

IUPAC2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone
SMILESNC1(CC(=O)N2CCCC(O)C2)CCCC1
InChIInChI=1S/C12H22N2O2/c13-12(5-1-2-6-12)8-11(16)14-7-3-4-10(15)9-14/h10,15H,1-9,13H2
InChIKeyMRYSOWCOVMHESS-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.63
Rot. Bonds2

About 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone

2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone (PubChem CID 64683579) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone
PubChem CID64683579
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone
SMILESNC1(CC(=O)N2CCCC(O)C2)CCCC1
InChIInChI=1S/C12H22N2O2/c13-12(5-1-2-6-12)8-11(16)14-7-3-4-10(15)9-14/h10,15H,1-9,13H2
InChIKeyMRYSOWCOVMHESS-UHFFFAOYSA-N
XLogP0.63
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclobutyl)-1-[(3S)-3-hydroxypyrrolidin-1-yl]ethanone
CID 107217433
2-(1-aminocyclobutyl)-1-(3-hydroxyazetidin-1-yl)ethanone
CID 107217667
2-(1-aminocyclopentyl)-1-[3-(trifluoromethyl)piperidin-1-yl]ethanone
CID 64684265
2-(1-aminocyclopentyl)-1-(3-ethoxypiperidin-1-yl)ethanone
CID 64677827
1-[2-(1-aminocyclohexyl)acetyl]pyrrolidine-3-carboxamide
CID 114081869
2-(1-aminocyclopentyl)-1-(3-tert-butylpyrrolidin-1-yl)ethanone
CID 113417335
2-(1-aminocyclohexyl)-1-(3-piperidin-1-ylpyrrolidin-1-yl)ethanone
CID 64678060
N-[(3R)-1-[2-(1-aminocyclobutyl)acetyl]piperidin-3-yl]acetamide
CID 124516868
(1-aminocyclobutyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107222967
1-(3-hydroxypiperidin-1-yl)but-3-en-1-one
CID 62677982
2-(1-aminocyclobutyl)-1-(azepan-1-yl)ethanone
CID 79851408
1-[2-(1-aminocyclobutyl)acetyl]piperidine-3,4-dicarboxylic acid
CID 115918559

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone?
The IUPAC name of 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone (CID 64683579) is 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone?
The canonical SMILES for 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone is NC1(CC(=O)N2CCCC(O)C2)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone?
The InChIKey is MRYSOWCOVMHESS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c13-12(5-1-2-6-12)8-11(16)14-7-3-4-10(15)9-14/h10,15H,1-9,13H2.
What are the key properties of 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone?
2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone has a molecular weight of 226.32 g/mol, XLogP of 0.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-1-(3-hydroxypiperidin-1-yl)ethanone is sourced from PubChem (CID 64683579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).