5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one

C10H16N2O3 — CID 103745537

IUPAC5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one
SMILESO=C1CCC(C(=O)N2CC[C@H](O)C2)CN1
InChIInChI=1S/C10H16N2O3/c13-8-3-4-12(6-8)10(15)7-1-2-9(14)11-5-7/h7-8,13H,1-6H2,(H,11,14)/t7?,8-/m0/s1
InChIKeyGKCJVRZYECMVDA-MQWKRIRWSA-N
MW212.25 g/mol
LogP-0.89
Rot. Bonds1

About 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one

5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one (PubChem CID 103745537) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one.

Molecular Properties

Compound Name5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one
PubChem CID103745537
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one
SMILESO=C1CCC(C(=O)N2CC[C@H](O)C2)CN1
InChIInChI=1S/C10H16N2O3/c13-8-3-4-12(6-8)10(15)7-1-2-9(14)11-5-7/h7-8,13H,1-6H2,(H,11,14)/t7?,8-/m0/s1
InChIKeyGKCJVRZYECMVDA-MQWKRIRWSA-N
XLogP-0.89
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3,9-diazabicyclo[4.2.1]nonane-3-carbonyl)piperidin-2-one
CID 81483173
5-(azepane-1-carbonyl)piperidin-2-one
CID 112728735
5-(azocane-1-carbonyl)piperidin-2-one
CID 112728799
2-[1-(6-oxopiperidine-3-carbonyl)pyrrolidin-3-yl]acetic acid
CID 83192169
5-[4-(aminomethyl)piperidine-1-carbonyl]piperidin-2-one
CID 81470340
2-(6-oxopiperidine-3-carbonyl)-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82863483
5-(1,1-dioxo-1,4-thiazinane-4-carbonyl)piperidin-2-one
CID 78928154
5-[3-(methylamino)piperidine-1-carbonyl]piperidin-2-one;hydrochloride
CID 119492394
5-(3,5-dimethylpiperazine-1-carbonyl)piperidin-2-one;hydrochloride
CID 119564607
1-(5-oxopyrrolidine-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 81456758
4-(6-oxopiperidine-3-carbonyl)piperazine-1-sulfonamide
CID 78954698
5-[4-(cyclopropylmethyl)piperazine-1-carbonyl]piperidin-2-one
CID 112732285

Frequently Asked Questions

What is the IUPAC name of 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one?
The IUPAC name of 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one (CID 103745537) is 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one.
What is the SMILES notation for 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one?
The canonical SMILES for 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one is O=C1CCC(C(=O)N2CC[C@H](O)C2)CN1.
What is the InChIKey of 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one?
The InChIKey is GKCJVRZYECMVDA-MQWKRIRWSA-N. The full InChI is InChI=1S/C10H16N2O3/c13-8-3-4-12(6-8)10(15)7-1-2-9(14)11-5-7/h7-8,13H,1-6H2,(H,11,14)/t7?,8-/m0/s1.
What are the key properties of 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one?
5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one has a molecular weight of 212.25 g/mol, XLogP of -0.89, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]piperidin-2-one is sourced from PubChem (CID 103745537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).