bis(4-methylphenyl)-pyrrolidin-2-ylmethanol

C19H23NO — CID 14813972

IUPACbis(4-methylphenyl)-pyrrolidin-2-ylmethanol
SMILESCc1ccc(C(O)(c2ccc(C)cc2)C2CCCN2)cc1
InChIInChI=1S/C19H23NO/c1-14-5-9-16(10-6-14)19(21,18-4-3-13-20-18)17-11-7-15(2)8-12-17/h5-12,18,20-21H,3-4,13H2,1-2H3
InChIKeyFFFPARXSSPKJIS-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.29
Rot. Bonds3

About bis(4-methylphenyl)-pyrrolidin-2-ylmethanol

bis(4-methylphenyl)-pyrrolidin-2-ylmethanol (PubChem CID 14813972) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is bis(4-methylphenyl)-pyrrolidin-2-ylmethanol.

Molecular Properties

Compound Namebis(4-methylphenyl)-pyrrolidin-2-ylmethanol
PubChem CID14813972
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Namebis(4-methylphenyl)-pyrrolidin-2-ylmethanol
SMILESCc1ccc(C(O)(c2ccc(C)cc2)C2CCCN2)cc1
InChIInChI=1S/C19H23NO/c1-14-5-9-16(10-6-14)19(21,18-4-3-13-20-18)17-11-7-15(2)8-12-17/h5-12,18,20-21H,3-4,13H2,1-2H3
InChIKeyFFFPARXSSPKJIS-UHFFFAOYSA-N
XLogP3.29
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

bis(4-fluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
CID 6544419
alpha,alpha-Diphenyl-2-pyrrolidinemethanol borane
CID 19782534
diphenyl-[(2S)-pyrrolidin-2-yl]methanol;trimethyl(trimethylsilyloxy)silane
CID 138393439
(3,5-dimethylphenyl)-[3-methyl-5-(trifluoromethyl)phenyl]-[(2R)-pyrrolidin-2-yl]methanol
CID 59628696
1-(4-methylphenyl)-2-pyrrolidin-2-ylpropan-2-ol
CID 105474764
dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol
CID 2733810
bis(3,4-difluorophenyl)-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
CID 45357010
(4-chlorophenyl)-phenyl-piperidin-2-ylmethanol
CID 3064310
1-(3-methylphenyl)-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 155141493
bis(3,5-diphenylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 59628921
2-[(2R)-pyrrolidin-2-yl]propan-2-ol
CID 12732175
(1S)-1-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 13068815

Frequently Asked Questions

What is the IUPAC name of bis(4-methylphenyl)-pyrrolidin-2-ylmethanol?
The IUPAC name of bis(4-methylphenyl)-pyrrolidin-2-ylmethanol (CID 14813972) is bis(4-methylphenyl)-pyrrolidin-2-ylmethanol.
What is the SMILES notation for bis(4-methylphenyl)-pyrrolidin-2-ylmethanol?
The canonical SMILES for bis(4-methylphenyl)-pyrrolidin-2-ylmethanol is Cc1ccc(C(O)(c2ccc(C)cc2)C2CCCN2)cc1.
What is the InChIKey of bis(4-methylphenyl)-pyrrolidin-2-ylmethanol?
The InChIKey is FFFPARXSSPKJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-14-5-9-16(10-6-14)19(21,18-4-3-13-20-18)17-11-7-15(2)8-12-17/h5-12,18,20-21H,3-4,13H2,1-2H3.
What are the key properties of bis(4-methylphenyl)-pyrrolidin-2-ylmethanol?
bis(4-methylphenyl)-pyrrolidin-2-ylmethanol has a molecular weight of 281.40 g/mol, XLogP of 3.29, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-methylphenyl)-pyrrolidin-2-ylmethanol is sourced from PubChem (CID 14813972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).