(4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone

C10H11ClN2O2 — CID 103873753

IUPAC(4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
SMILESO=C(c1cnccc1Cl)N1CC[C@@H](O)C1
InChIInChI=1S/C10H11ClN2O2/c11-9-1-3-12-5-8(9)10(15)13-4-2-7(14)6-13/h1,3,5,7,14H,2,4,6H2/t7-/m1/s1
InChIKeyQIUUJFTWFISXIO-SSDOTTSWSA-N
MW226.66 g/mol
LogP0.94
Rot. Bonds1

About (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone

(4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone (PubChem CID 103873753) has the molecular formula C10H11ClN2O2 and a molecular weight of 226.66 g/mol. Its IUPAC name is (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
PubChem CID103873753
Molecular FormulaC10H11ClN2O2
Molecular Weight226.66 g/mol
Exact Mass226.05
IUPAC Name(4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
SMILESO=C(c1cnccc1Cl)N1CC[C@@H](O)C1
InChIInChI=1S/C10H11ClN2O2/c11-9-1-3-12-5-8(9)10(15)13-4-2-7(14)6-13/h1,3,5,7,14H,2,4,6H2/t7-/m1/s1
InChIKeyQIUUJFTWFISXIO-SSDOTTSWSA-N
XLogP0.94
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.66
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-chloro-3-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone
CID 81226182
(4-chloro-3-pyridinyl)-[3-(dimethylamino)pyrrolidin-1-yl]methanone
CID 81226397
(3-fluoro-4-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66291522
(4-chloro-3-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone
CID 81225158
(3-hydroxypyrrolidin-1-yl)-pyridin-4-ylmethanone
CID 62917595
[4-(4-chloropyridine-3-carbonyl)piperazin-1-yl]-cyclopropylmethanone
CID 81225735
1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl-(4-chloro-3-pyridinyl)methanone
CID 81226844
(4-chloro-3-pyridinyl)-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)methanone
CID 81232347
(4-chloro-3-pyridinyl)-[3-(dimethylamino)piperidin-1-yl]methanone
CID 81233181
[3-(4-hydroxybut-1-ynyl)-4-pyridinyl]-(3-hydroxypyrrolidin-1-yl)methanone
CID 66484039
(4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-(4-chloro-3-pyridinyl)methanone
CID 81232865
(3,4-dichlorophenyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66261191

Frequently Asked Questions

What is the IUPAC name of (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The IUPAC name of (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone (CID 103873753) is (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone.
What is the SMILES notation for (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The canonical SMILES for (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone is O=C(c1cnccc1Cl)N1CC[C@@H](O)C1.
What is the InChIKey of (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The InChIKey is QIUUJFTWFISXIO-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H11ClN2O2/c11-9-1-3-12-5-8(9)10(15)13-4-2-7(14)6-13/h1,3,5,7,14H,2,4,6H2/t7-/m1/s1.
What are the key properties of (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
(4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone has a molecular weight of 226.66 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone is sourced from PubChem (CID 103873753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).