2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide

C16H18N2O2 — CID 111332577

IUPAC2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide
SMILESO=C(CN1CC[C@@H](O)C1)Nc1cccc2ccccc12
InChIInChI=1S/C16H18N2O2/c19-13-8-9-18(10-13)11-16(20)17-15-7-3-5-12-4-1-2-6-14(12)15/h1-7,13,19H,8-11H2,(H,17,20)/t13-/m1/s1
InChIKeyNBLCYNHAXKCRQD-CYBMUJFWSA-N
MW270.33 g/mol
LogP1.84
Rot. Bonds3

About 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide

2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide (PubChem CID 111332577) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide
PubChem CID111332577
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide
SMILESO=C(CN1CC[C@@H](O)C1)Nc1cccc2ccccc12
InChIInChI=1S/C16H18N2O2/c19-13-8-9-18(10-13)11-16(20)17-15-7-3-5-12-4-1-2-6-14(12)15/h1-7,13,19H,8-11H2,(H,17,20)/t13-/m1/s1
InChIKeyNBLCYNHAXKCRQD-CYBMUJFWSA-N
XLogP1.84
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dimethylphenyl)-2-[(3R)-3-hydroxypyrrolidin-1-yl]acetamide
CID 78963336
3-hydroxy-N-naphthalen-1-ylpyrrolidine-1-carboxamide
CID 62918134
N-(4-methylphenyl)-1-[2-(naphthalen-1-ylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 16910303
2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-(3-iodophenyl)acetamide
CID 78962531
N-(2-chlorophenyl)-3-[(3R)-3-hydroxypyrrolidin-1-yl]propanamide
CID 78963268
N-(4-fluorophenyl)-2-[4-[2-(naphthalen-1-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 29166438
N-(2,4-dibromophenyl)-2-(3-hydroxypyrrolidin-1-yl)acetamide
CID 62917994
1-[2-(naphthalen-1-ylamino)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide
CID 16910314
2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 31478295
2-[2-(4-hydroxypiperidin-1-yl)anilino]-N-naphthalen-1-ylacetamide
CID 51121729
N-[(4-fluorophenyl)methyl]-1-[2-(naphthalen-1-ylamino)-2-oxoethyl]piperidine-4-carboxamide
CID 16910281
N-(2,3-dimethylphenyl)-2-(3-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 103898054

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide (CID 111332577) is 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide is O=C(CN1CC[C@@H](O)C1)Nc1cccc2ccccc12.
What is the InChIKey of 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide?
The InChIKey is NBLCYNHAXKCRQD-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H18N2O2/c19-13-8-9-18(10-13)11-16(20)17-15-7-3-5-12-4-1-2-6-14(12)15/h1-7,13,19H,8-11H2,(H,17,20)/t13-/m1/s1.
What are the key properties of 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide?
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide has a molecular weight of 270.33 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 111332577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).