[4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone

C12H23N3O2 — CID 43501381

IUPAC[4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone
SMILESO=C(C1CCCCN1)N1CCN(CCO)CC1
InChIInChI=1S/C12H23N3O2/c16-10-9-14-5-7-15(8-6-14)12(17)11-3-1-2-4-13-11/h11,13,16H,1-10H2
InChIKeyNFWJRAXGSDEBKP-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.74
Rot. Bonds3

About [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone

[4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone (PubChem CID 43501381) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone.

Molecular Properties

Compound Name[4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone
PubChem CID43501381
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name[4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone
SMILESO=C(C1CCCCN1)N1CCN(CCO)CC1
InChIInChI=1S/C12H23N3O2/c16-10-9-14-5-7-15(8-6-14)12(17)11-3-1-2-4-13-11/h11,13,16H,1-10H2
InChIKeyNFWJRAXGSDEBKP-UHFFFAOYSA-N
XLogP-0.74
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(2-methoxyethyl)piperazin-1-yl]-[(2R)-piperidin-2-yl]methanone
CID 119838507
[4-(2-methylpropyl)piperazin-1-yl]-[(2S)-piperidin-2-yl]methanone
CID 103813273
[(2R)-piperidin-2-yl]-(4-prop-2-ynylpiperazin-1-yl)methanone
CID 93375251
piperidin-2-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
CID 61259978
azepan-1-yl(azepan-2-yl)methanone
CID 64562203
azepan-1-yl-[(2R)-piperidin-2-yl]methanone
CID 7183049
azepan-2-yl-(4-prop-2-ynylpiperazin-1-yl)methanone
CID 64562668
[4-(2-methoxyethyl)piperazin-1-yl]-pyrrolidin-2-ylmethanone;dihydrochloride
CID 119838561
azocan-1-yl-[(2S)-piperidin-2-yl]methanone;hydrochloride
CID 119676414
azepan-1-yl-[(2S)-piperidin-2-yl]methanone;hydrochloride
CID 119669545
(4-ethylpiperazin-1-yl)-pyrrolidin-2-ylmethanone;dihydrochloride
CID 119032238
azepan-2-yl-(4-cyclopentylpiperazin-1-yl)methanone
CID 64570539

Frequently Asked Questions

What is the IUPAC name of [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone?
The IUPAC name of [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone (CID 43501381) is [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone.
What is the SMILES notation for [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone?
The canonical SMILES for [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone is O=C(C1CCCCN1)N1CCN(CCO)CC1.
What is the InChIKey of [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone?
The InChIKey is NFWJRAXGSDEBKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c16-10-9-14-5-7-15(8-6-14)12(17)11-3-1-2-4-13-11/h11,13,16H,1-10H2.
What are the key properties of [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone?
[4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone has a molecular weight of 241.33 g/mol, XLogP of -0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-hydroxyethyl)piperazin-1-yl]-piperidin-2-ylmethanone is sourced from PubChem (CID 43501381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).