(2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone

C17H17NO2 — CID 154351103

IUPAC(2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone
SMILESO=C(c1cccc(-c2ccccc2)c1O)N1CCCC1
InChIInChI=1S/C17H17NO2/c19-16-14(13-7-2-1-3-8-13)9-6-10-15(16)17(20)18-11-4-5-12-18/h1-3,6-10,19H,4-5,11-12H2
InChIKeyRESBROHVLDEEQL-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.30
Rot. Bonds2

About (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone

(2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone (PubChem CID 154351103) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone
PubChem CID154351103
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name(2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone
SMILESO=C(c1cccc(-c2ccccc2)c1O)N1CCCC1
InChIInChI=1S/C17H17NO2/c19-16-14(13-7-2-1-3-8-13)9-6-10-15(16)17(20)18-11-4-5-12-18/h1-3,6-10,19H,4-5,11-12H2
InChIKeyRESBROHVLDEEQL-UHFFFAOYSA-N
XLogP3.30
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-3-phenylbenzoic acid;hydrate
CID 141168272
[5-(fluoren-9-ylideneamino)-2-hydroxy-3-phenylphenyl]-piperidin-1-ylmethanone
CID 91724224
[2-(4-fluorophenyl)phenyl]-pyrrolidin-1-ylmethanone
CID 134955966
9H-fluoren-4-yl(pyrrolidin-1-yl)methanone
CID 1214982
(2-phenylphenyl)-thiomorpholin-4-ylmethanone
CID 47227510
2-hydroxy-3-(2-phenylphenyl)benzoic acid
CID 67822406
4-phenyl-5-(pyrrolidine-1-carbonyl)-1H-pyridin-2-one
CID 175705601
(3-methylpiperidin-1-yl)-(2-phenylphenyl)methanone
CID 145074251
[2-(piperidine-1-carbonyl)phenyl]boronic acid
CID 90477220
2-iodo-3-(pyrrolidine-1-carbonyl)benzoic acid
CID 169449836
3-anilino-4-[2-hydroxy-3-(pyrrolidine-1-carbonyl)anilino]cyclobut-3-ene-1,2-dione
CID 59068176
8-(pyrrolidine-1-carbonyl)naphthalene-1-carboxylic acid
CID 16773543

Frequently Asked Questions

What is the IUPAC name of (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone (CID 154351103) is (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone is O=C(c1cccc(-c2ccccc2)c1O)N1CCCC1.
What is the InChIKey of (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone?
The InChIKey is RESBROHVLDEEQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c19-16-14(13-7-2-1-3-8-13)9-6-10-15(16)17(20)18-11-4-5-12-18/h1-3,6-10,19H,4-5,11-12H2.
What are the key properties of (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone?
(2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone has a molecular weight of 267.33 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxy-3-phenylphenyl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 154351103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).