4-naphthalen-1-yloxypyrrolidin-3-ol

C14H15NO2 — CID 13192217

IUPAC4-naphthalen-1-yloxypyrrolidin-3-ol
SMILESOC1CNCC1Oc1cccc2ccccc12
InChIInChI=1S/C14H15NO2/c16-12-8-15-9-14(12)17-13-7-3-5-10-4-1-2-6-11(10)13/h1-7,12,14-16H,8-9H2
InChIKeyQRDWNJTVUHULPK-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.55
Rot. Bonds2

About 4-naphthalen-1-yloxypyrrolidin-3-ol

4-naphthalen-1-yloxypyrrolidin-3-ol (PubChem CID 13192217) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 4-naphthalen-1-yloxypyrrolidin-3-ol.

Molecular Properties

Compound Name4-naphthalen-1-yloxypyrrolidin-3-ol
PubChem CID13192217
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name4-naphthalen-1-yloxypyrrolidin-3-ol
SMILESOC1CNCC1Oc1cccc2ccccc12
InChIInChI=1S/C14H15NO2/c16-12-8-15-9-14(12)17-13-7-3-5-10-4-1-2-6-11(10)13/h1-7,12,14-16H,8-9H2
InChIKeyQRDWNJTVUHULPK-UHFFFAOYSA-N
XLogP1.55
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-naphthalen-1-yloxyazetidine;hydrochloride
CID 22451506
4-(2,6-dichlorophenoxy)pyrrolidin-3-ol
CID 13320223
N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-naphthalen-1-yloxyacetamide
CID 120944120
(3S,4S)-1-ethyl-4-naphthalen-1-yloxypyrrolidin-3-ol
CID 22826654
4-(2-methyl-3-nitrophenoxy)pyrrolidin-3-ol
CID 55232188
3-hydroxy-4-naphthalen-1-yloxypiperidine-1-carbaldehyde
CID 20548849
(3S,4R)-4-(4-fluorophenoxy)pyrrolidin-3-ol
CID 67294277
[(3S,4S)-4-(2-naphthalen-1-ylacetyl)oxypyrrolidin-3-yl] 2-naphthalen-1-ylacetate
CID 54754546
2-naphthalen-1-yloxy-2,3-dihydro-1H-inden-1-amine
CID 43100876
4-(4-iodophenoxy)pyrrolidin-3-ol
CID 63702649
(3S,4S)-4-(2,3,4,5,6-pentafluorophenoxy)pyrrolidin-3-ol
CID 114203459
dinaphthalen-1-yloxymethanethione
CID 22635249

Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-1-yloxypyrrolidin-3-ol?
The IUPAC name of 4-naphthalen-1-yloxypyrrolidin-3-ol (CID 13192217) is 4-naphthalen-1-yloxypyrrolidin-3-ol.
What is the SMILES notation for 4-naphthalen-1-yloxypyrrolidin-3-ol?
The canonical SMILES for 4-naphthalen-1-yloxypyrrolidin-3-ol is OC1CNCC1Oc1cccc2ccccc12.
What is the InChIKey of 4-naphthalen-1-yloxypyrrolidin-3-ol?
The InChIKey is QRDWNJTVUHULPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c16-12-8-15-9-14(12)17-13-7-3-5-10-4-1-2-6-11(10)13/h1-7,12,14-16H,8-9H2.
What are the key properties of 4-naphthalen-1-yloxypyrrolidin-3-ol?
4-naphthalen-1-yloxypyrrolidin-3-ol has a molecular weight of 229.28 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-1-yloxypyrrolidin-3-ol is sourced from PubChem (CID 13192217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).