(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol

C14H21NO — CID 78939880

IUPAC(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol
SMILESCCC1CCCN1c1ccccc1[C@@H](C)O
InChIInChI=1S/C14H21NO/c1-3-12-7-6-10-15(12)14-9-5-4-8-13(14)11(2)16/h4-5,8-9,11-12,16H,3,6-7,10H2,1-2H3/t11-,12?/m1/s1
InChIKeyAPNHAOYTGLDEFR-JHJMLUEUSA-N
MW219.33 g/mol
LogP3.12
Rot. Bonds3

About (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol

(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol (PubChem CID 78939880) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol
PubChem CID78939880
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol
SMILESCCC1CCCN1c1ccccc1[C@@H](C)O
InChIInChI=1S/C14H21NO/c1-3-12-7-6-10-15(12)14-9-5-4-8-13(14)11(2)16/h4-5,8-9,11-12,16H,3,6-7,10H2,1-2H3/t11-,12?/m1/s1
InChIKeyAPNHAOYTGLDEFR-JHJMLUEUSA-N
XLogP3.12
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 ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol
CID 63370962
(1R)-1-[2-(2-ethylazepan-1-yl)phenyl]ethanol
CID 104690574
(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]propan-1-amine
CID 103958582
[2-(2-ethylpyrrolidin-1-yl)phenyl]methanol
CID 60973877
1-[2-(2-ethylpiperidin-1-yl)phenyl]-N-methylpropan-1-amine
CID 112677835
2-(2-ethylpyrrolidin-1-yl)benzaldehyde
CID 60973642
(1S)-1-[3-bromo-4-(2-ethylpyrrolidin-1-yl)phenyl]ethanol
CID 78939883
2-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanamine
CID 63784557
5-(2-ethylpiperidin-1-yl)-2-(1-hydroxyethyl)phenol
CID 79603663
1-[2-[(1R)-1-hydroxyethyl]phenyl]-3,4,4a,6,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-5-one
CID 103196849
3-[1-[2-[1-(methylamino)ethyl]phenyl]pyrrolidin-2-yl]propan-1-ol
CID 62467578
N-[[2-(2-ethylazepan-1-yl)phenyl]methyl]propan-2-amine
CID 104690764

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol?
The IUPAC name of (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol (CID 78939880) is (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol?
The canonical SMILES for (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol is CCC1CCCN1c1ccccc1[C@@H](C)O.
What is the InChIKey of (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol?
The InChIKey is APNHAOYTGLDEFR-JHJMLUEUSA-N. The full InChI is InChI=1S/C14H21NO/c1-3-12-7-6-10-15(12)14-9-5-4-8-13(14)11(2)16/h4-5,8-9,11-12,16H,3,6-7,10H2,1-2H3/t11-,12?/m1/s1.
What are the key properties of (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol?
(1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol has a molecular weight of 219.33 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(2-ethylpyrrolidin-1-yl)phenyl]ethanol is sourced from PubChem (CID 78939880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).