2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol

C14H21NO — CID 110932472

IUPAC2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol
SMILESCC(C)(O)CN1CCCC1c1ccccc1
InChIInChI=1S/C14H21NO/c1-14(2,16)11-15-10-6-9-13(15)12-7-4-3-5-8-12/h3-5,7-8,13,16H,6,9-11H2,1-2H3
InChIKeyDSCSEHOTKJRSRP-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.59
Rot. Bonds3

About 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol

2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol (PubChem CID 110932472) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol
PubChem CID110932472
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol
SMILESCC(C)(O)CN1CCCC1c1ccccc1
InChIInChI=1S/C14H21NO/c1-14(2,16)11-15-10-6-9-13(15)12-7-4-3-5-8-12/h3-5,7-8,13,16H,6,9-11H2,1-2H3
InChIKeyDSCSEHOTKJRSRP-UHFFFAOYSA-N
XLogP2.59
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-ethyl-2-phenylpyrrolidine
CID 177062481
1-ethyl-2-phenylazepane
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CID 163924303
2-(2-phenylpiperidin-1-yl)acetic acid
CID 23201321
2-methyl-2-(2-phenylpyrrolidin-1-yl)propan-1-amine
CID 104523147
1-butyl-2-phenylpiperidine
CID 10036306
2,2-dimethyl-1-[(2R)-2-phenylpyrrolidin-1-yl]propane-1-thione
CID 138963743
N-phenyl-2-(2-phenylpyrrolidin-1-yl)acetamide
CID 18137699
N-(2-acetylphenyl)-2-[(2R)-2-phenylpyrrolidin-1-yl]acetamide
CID 41456108
2-methyl-1-(3-phenylazetidin-1-yl)propan-2-ol
CID 104549809
2-(2-phenylpiperidin-1-yl)ethanamine
CID 69157822
2-phenylpyrrolidin-1-amine;hydrochloride
CID 75360806

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol?
The IUPAC name of 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol (CID 110932472) is 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol.
What is the SMILES notation for 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol?
The canonical SMILES for 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol is CC(C)(O)CN1CCCC1c1ccccc1.
What is the InChIKey of 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol?
The InChIKey is DSCSEHOTKJRSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-14(2,16)11-15-10-6-9-13(15)12-7-4-3-5-8-12/h3-5,7-8,13,16H,6,9-11H2,1-2H3.
What are the key properties of 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol?
2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol has a molecular weight of 219.33 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-phenylpyrrolidin-1-yl)propan-2-ol is sourced from PubChem (CID 110932472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).