3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol

C14H21NO — CID 69333392

IUPAC3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol
SMILESCC1CCCN1c1ccccc1CCCO
InChIInChI=1S/C14H21NO/c1-12-6-4-10-15(12)14-9-3-2-7-13(14)8-5-11-16/h2-3,7,9,12,16H,4-6,8,10-11H2,1H3
InChIKeyKOYVOROQOINWGB-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.60
Rot. Bonds4

About 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol

3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol (PubChem CID 69333392) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol.

Molecular Properties

Compound Name3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol
PubChem CID69333392
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol
SMILESCC1CCCN1c1ccccc1CCCO
InChIInChI=1S/C14H21NO/c1-12-6-4-10-15(12)14-9-3-2-7-13(14)8-5-11-16/h2-3,7,9,12,16H,4-6,8,10-11H2,1H3
InChIKeyKOYVOROQOINWGB-UHFFFAOYSA-N
XLogP2.60
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(2S)-2-methylpiperidin-1-yl]phenyl]methanamine
CID 26871970
3-[2-[4-(hydroxymethyl)piperidin-1-yl]phenyl]propan-1-ol
CID 170887594
2-[1-(2-ethylphenyl)pyrrolidin-2-yl]ethanol
CID 117028523
N-[[2-(2-methylpiperidin-1-yl)phenyl]methyl]propan-1-amine
CID 43280373
[2-chloro-6-(2-methylpyrrolidin-1-yl)phenyl]methanol
CID 60974509
[2-(2-ethylpyrrolidin-1-yl)phenyl]methanol
CID 60973877
2-[2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)phenyl]ethanamine
CID 65322647
2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine
CID 63784557
[1-[2-(aminomethyl)phenyl]pyrrolidin-2-yl]methanol
CID 61407421
(1S)-1-[2-(2-methylazepan-1-yl)phenyl]propan-1-ol
CID 103960186
N-[[2-(2,4-dimethylpiperidin-1-yl)phenyl]methyl]propan-2-amine
CID 62331056
1-[2-(2-methylazepan-1-yl)phenyl]propan-1-one
CID 112677458

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol?
The IUPAC name of 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol (CID 69333392) is 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol.
What is the SMILES notation for 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol?
The canonical SMILES for 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol is CC1CCCN1c1ccccc1CCCO.
What is the InChIKey of 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol?
The InChIKey is KOYVOROQOINWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-12-6-4-10-15(12)14-9-3-2-7-13(14)8-5-11-16/h2-3,7,9,12,16H,4-6,8,10-11H2,1H3.
What are the key properties of 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol?
3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methylpyrrolidin-1-yl)phenyl]propan-1-ol is sourced from PubChem (CID 69333392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).