1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one

C14H22N2O2 — CID 115758760

IUPAC1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one
SMILESCC(O)CC1CCCN1CCn1ccccc1=O
InChIInChI=1S/C14H22N2O2/c1-12(17)11-13-5-4-8-15(13)9-10-16-7-3-2-6-14(16)18/h2-3,6-7,12-13,17H,4-5,8-11H2,1H3
InChIKeyYJMJGYGLWRSJSO-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.08
Rot. Bonds5

About 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one

1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one (PubChem CID 115758760) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one.

Molecular Properties

Compound Name1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one
PubChem CID115758760
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one
SMILESCC(O)CC1CCCN1CCn1ccccc1=O
InChIInChI=1S/C14H22N2O2/c1-12(17)11-13-5-4-8-15(13)9-10-16-7-3-2-6-14(16)18/h2-3,6-7,12-13,17H,4-5,8-11H2,1H3
InChIKeyYJMJGYGLWRSJSO-UHFFFAOYSA-N
XLogP1.08
TPSA45.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[2-(2-Hydroxypropyl)pyrrolidin-1-yl]-2-oxoethyl]-3-(trifluoromethyl)pyridin-2-one
CID 112421013
1-[(2R,3S)-2-[bis(prop-2-enyl)amino]-3-hydroxyhexyl]pyridin-2-one
CID 10424331
5-Amino-1-[2-[2-(3-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one
CID 55075922
4-[2-(3-Hydroxypropyl)pyrrolidine-1-carbonyl]-1-methylpyridin-2-one
CID 55076455
5-Amino-1-[2-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)ethyl]pyridin-2-one
CID 55243755
1-[3-[2-(3-Hydroxypropyl)pyrrolidin-1-yl]-3-oxopropyl]pyridin-2-one
CID 62468619
5-Amino-1-[2-[2-(3-hydroxypropyl)pyrrolidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 62815151
1-[3-(3-Hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-3-oxopropyl]pyridin-2-one
CID 63763060
1-[3-[2-[(Dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]-3-oxopropyl]pyridin-2-one
CID 66053161
4-[2-[(Dimethylamino)methyl]-4-hydroxypyrrolidine-1-carbonyl]-1-methylpyridin-2-one
CID 66054111
5-Amino-1-[2-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]ethyl]pyridin-2-one
CID 66056574
1-(3-Hydroxy-8-azabicyclo[3.2.1]octan-8-yl)hexa-2,4-dien-1-one
CID 76952464

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one?
The IUPAC name of 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one (CID 115758760) is 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one.
What is the SMILES notation for 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one?
The canonical SMILES for 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one is CC(O)CC1CCCN1CCn1ccccc1=O.
What is the InChIKey of 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one?
The InChIKey is YJMJGYGLWRSJSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-12(17)11-13-5-4-8-15(13)9-10-16-7-3-2-6-14(16)18/h2-3,6-7,12-13,17H,4-5,8-11H2,1H3.
What are the key properties of 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one?
1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one has a molecular weight of 250.34 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-hydroxypropyl)pyrrolidin-1-yl]ethyl]pyridin-2-one is sourced from PubChem (CID 115758760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).