1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one

C14H24N2O3 — CID 60694146

IUPAC1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one
SMILESO=C1CCCN1C(=O)CN(CCO)C1CCCCC1
InChIInChI=1S/C14H24N2O3/c17-10-9-15(12-5-2-1-3-6-12)11-14(19)16-8-4-7-13(16)18/h12,17H,1-11H2
InChIKeyNUULXSPAFUMODI-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.76
Rot. Bonds5

About 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one

1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one (PubChem CID 60694146) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one
PubChem CID60694146
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one
SMILESO=C1CCCN1C(=O)CN(CCO)C1CCCCC1
InChIInChI=1S/C14H24N2O3/c17-10-9-15(12-5-2-1-3-6-12)11-14(19)16-8-4-7-13(16)18/h12,17H,1-11H2
InChIKeyNUULXSPAFUMODI-UHFFFAOYSA-N
XLogP0.76
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[Cyclohexyl(2-hydroxypropyl)amino]-1-(2,2,2-trifluoroethyl)pyrrolidin-2-one
CID 60295572
1-(2-hydroxyethyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 21936015
[1-(2-Hydroxyethyl)pyrrolidin-2-yl]-piperidin-1-ylmethanone
CID 21936022
[1-(2-Hydroxyethyl)pyrrolidin-2-yl]-(4-methylpiperazin-1-yl)methanone
CID 22140753
1-Cyclohexyl-3-(diethylamino)-4-hydroxypyrrolidin-2-one
CID 22753024
[4-(2-Hydroxyethyl)piperazin-1-yl]-(1-methylpyrrolidin-2-yl)methanone
CID 57054411
2-Hydroxyethyl-dimethyl-[2-(2-methyl-5-oxopyrrolidin-1-yl)ethyl]azanium
CID 58298541
[(2S)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-(4-methylpiperazin-1-yl)methanone
CID 68578125
[(2S)-1-(2-hydroxyethyl)pyrrolidin-2-yl]-piperidin-1-ylmethanone
CID 68579406
(2S)-1-(2-hydroxyethyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 69067247
1-[2-[2-Hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one
CID 70877760
(2R)-N,N-bis(2-hydroxyethyl)-1-methylpyrrolidine-2-carboxamide
CID 145681796

Frequently Asked Questions

What is the IUPAC name of 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one (CID 60694146) is 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one is O=C1CCCN1C(=O)CN(CCO)C1CCCCC1.
What is the InChIKey of 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one?
The InChIKey is NUULXSPAFUMODI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c17-10-9-15(12-5-2-1-3-6-12)11-14(19)16-8-4-7-13(16)18/h12,17H,1-11H2.
What are the key properties of 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one?
1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one has a molecular weight of 268.36 g/mol, XLogP of 0.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one is sourced from PubChem (CID 60694146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).