naphthalen-2-yl(pyrrolidin-1-yl)methanone

C15H15NO — CID 795353

IUPACnaphthalen-2-yl(pyrrolidin-1-yl)methanone
SMILESO=C(c1ccc2ccccc2c1)N1CCCC1
InChIInChI=1S/C15H15NO/c17-15(16-9-3-4-10-16)14-8-7-12-5-1-2-6-13(12)11-14/h1-2,5-8,11H,3-4,9-10H2
InChIKeyVDAYRZNQLUXFBQ-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.08
Rot. Bonds1

About naphthalen-2-yl(pyrrolidin-1-yl)methanone

naphthalen-2-yl(pyrrolidin-1-yl)methanone (PubChem CID 795353) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is naphthalen-2-yl(pyrrolidin-1-yl)methanone.

Molecular Properties

Compound Namenaphthalen-2-yl(pyrrolidin-1-yl)methanone
PubChem CID795353
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Namenaphthalen-2-yl(pyrrolidin-1-yl)methanone
SMILESO=C(c1ccc2ccccc2c1)N1CCCC1
InChIInChI=1S/C15H15NO/c17-15(16-9-3-4-10-16)14-8-7-12-5-1-2-6-13(12)11-14/h1-2,5-8,11H,3-4,9-10H2
InChIKeyVDAYRZNQLUXFBQ-UHFFFAOYSA-N
XLogP3.08
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Naphyrone
CID 11243002
2-Naphthalenecarboxamide
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Bunaftine
CID 36131
Pyrrolidine, 1-(o-benzoylbenzoyl)-
CID 208220
3-Azatricyclo[7.3.1.0,5,13]trideca-1(12),5(13),6,8,10-pentaen-2-one
CID 10130246
2,3-Naphthalenedicarboximide
CID 335194
2-Benzyl-1H-benzo(de)isoquinoline-1,3(2H)-dione
CID 267579
2-Naphthalenyl-1-piperidinylmethanone
CID 593461
2-Benzylisoindolin-1-one
CID 1485883
N-(3-Phenylallyl)phthalimide
CID 5389074
(S)-N-isobutyl-N-(pyrrolidin-3-yl)-2-naphthamide
CID 11220185
(R)-N-isobutyl-N-(pyrrolidin-3-yl)-2-naphthamide
CID 11323940

Frequently Asked Questions

What is the IUPAC name of naphthalen-2-yl(pyrrolidin-1-yl)methanone?
The IUPAC name of naphthalen-2-yl(pyrrolidin-1-yl)methanone (CID 795353) is naphthalen-2-yl(pyrrolidin-1-yl)methanone.
What is the SMILES notation for naphthalen-2-yl(pyrrolidin-1-yl)methanone?
The canonical SMILES for naphthalen-2-yl(pyrrolidin-1-yl)methanone is O=C(c1ccc2ccccc2c1)N1CCCC1.
What is the InChIKey of naphthalen-2-yl(pyrrolidin-1-yl)methanone?
The InChIKey is VDAYRZNQLUXFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c17-15(16-9-3-4-10-16)14-8-7-12-5-1-2-6-13(12)11-14/h1-2,5-8,11H,3-4,9-10H2.
What are the key properties of naphthalen-2-yl(pyrrolidin-1-yl)methanone?
naphthalen-2-yl(pyrrolidin-1-yl)methanone has a molecular weight of 225.29 g/mol, XLogP of 3.08, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-2-yl(pyrrolidin-1-yl)methanone is sourced from PubChem (CID 795353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).