1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol

C19H23NO — CID 70278414

IUPAC1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol
SMILESOC(CCN1CCCC1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H23NO/c21-19(12-15-20-13-4-5-14-20)18-10-8-17(9-11-18)16-6-2-1-3-7-16/h1-3,6-11,19,21H,4-5,12-15H2
InChIKeyCNZDKBRKQPHARV-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.87
Rot. Bonds5

About 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol

1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol (PubChem CID 70278414) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol.

Molecular Properties

Compound Name1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol
PubChem CID70278414
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol
SMILESOC(CCN1CCCC1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H23NO/c21-19(12-15-20-13-4-5-14-20)18-10-8-17(9-11-18)16-6-2-1-3-7-16/h1-3,6-11,19,21H,4-5,12-15H2
InChIKeyCNZDKBRKQPHARV-UHFFFAOYSA-N
XLogP3.87
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-morpholin-4-yl-1-(4-phenylphenyl)propan-1-ol
CID 3039644
3-(azepan-1-yl)-1-[4-[3-(azepan-1-yl)-1-hydroxypropyl]phenyl]propan-1-ol
CID 3774419
(1S)-3-pyrrolidin-1-yl-1-[4-(trifluoromethyl)phenyl]propan-1-ol
CID 70247468
1-(4-methylsulfanylphenyl)-3-piperidin-1-ylpropan-1-ol
CID 82074348
1-[4-(2-methylpropyl)phenyl]-3-pyrrolidin-1-ylpropan-1-ol
CID 112510765
1-(2-methoxy-4-phenylphenyl)-3-piperidin-1-ylpropan-1-ol
CID 21151554
1-(3-nitro-4-phenylphenyl)-3-piperidin-1-ylpropan-1-ol;hydrochloride
CID 3042292
1-(3-hydroxy-3-phenylpropyl)piperidin-3-ol
CID 55094317
(1R)-3-[2-[(3R)-3-hydroxy-3-phenylpropyl]-2,8-diazaspiro[5.5]undecan-8-yl]-1-phenylpropan-1-ol
CID 166211934
ethylcarbamic acid;1-phenyl-3-piperidin-1-ylpropan-1-ol;hydrobromide
CID 21153353
1-(3-hydroxy-3-phenylpropyl)-4-methylazepan-4-ol
CID 107408828
(1R)-3-(3-aminopiperidin-1-yl)-1-phenylpropan-1-ol
CID 112742222

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol?
The IUPAC name of 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol (CID 70278414) is 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol.
What is the SMILES notation for 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol?
The canonical SMILES for 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol is OC(CCN1CCCC1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol?
The InChIKey is CNZDKBRKQPHARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c21-19(12-15-20-13-4-5-14-20)18-10-8-17(9-11-18)16-6-2-1-3-7-16/h1-3,6-11,19,21H,4-5,12-15H2.
What are the key properties of 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol?
1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol has a molecular weight of 281.40 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenylphenyl)-3-pyrrolidin-1-ylpropan-1-ol is sourced from PubChem (CID 70278414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).