(1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol

C8H18N2O — CID 138485490

IUPAC(1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol
SMILESCN(C)C[C@@H](O)[C@@H]1CCCN1
InChIInChI=1S/C8H18N2O/c1-10(2)6-8(11)7-4-3-5-9-7/h7-9,11H,3-6H2,1-2H3/t7-,8+/m0/s1
InChIKeyPWFNYWSDZZUBBV-JGVFFNPUSA-N
MW158.25 g/mol
LogP-0.34
Rot. Bonds3

About (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol

(1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol (PubChem CID 138485490) has the molecular formula C8H18N2O and a molecular weight of 158.25 g/mol. Its IUPAC name is (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol.

Molecular Properties

Compound Name(1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol
PubChem CID138485490
Molecular FormulaC8H18N2O
Molecular Weight158.25 g/mol
Exact Mass158.14
IUPAC Name(1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol
SMILESCN(C)C[C@@H](O)[C@@H]1CCCN1
InChIInChI=1S/C8H18N2O/c1-10(2)6-8(11)7-4-3-5-9-7/h7-9,11H,3-6H2,1-2H3/t7-,8+/m0/s1
InChIKeyPWFNYWSDZZUBBV-JGVFFNPUSA-N
XLogP-0.34
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.25
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyrrolidin-2-ylpropan-1-ol;hydrochloride
CID 172641162
(1R)-4-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]butan-1-ol
CID 138485429
(1S)-2-(1-methylsiliran-1-yl)-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 142507527
(1S)-2-amino-1-pyrrolidin-2-ylethanol
CID 155010732
2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 164662041
(4R)-4-hydroxy-4-[(2S)-pyrrolidin-2-yl]butan-2-one
CID 155141506
(1S)-2-methylsulfonyl-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 138485657
1-pyrrolidin-2-ylbut-3-en-1-ol
CID 72814698
(1S)-2-[methyl-di(propan-2-yl)silyl]-1-[(2S)-pyrrolidin-2-yl]ethanol;sulfane
CID 167554400
1-(azepan-2-yl)ethane-1,2-diol
CID 115006977
2-[(2S)-pyrrolidin-2-yl]ethane-1,1,2-triol
CID 138712862
2-(5-ethylthiophen-2-yl)-1-pyrrolidin-2-ylethanol
CID 106639830

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol?
The IUPAC name of (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol (CID 138485490) is (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol.
What is the SMILES notation for (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol?
The canonical SMILES for (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol is CN(C)C[C@@H](O)[C@@H]1CCCN1.
What is the InChIKey of (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol?
The InChIKey is PWFNYWSDZZUBBV-JGVFFNPUSA-N. The full InChI is InChI=1S/C8H18N2O/c1-10(2)6-8(11)7-4-3-5-9-7/h7-9,11H,3-6H2,1-2H3/t7-,8+/m0/s1.
What are the key properties of (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol?
(1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol has a molecular weight of 158.25 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(dimethylamino)-1-[(2S)-pyrrolidin-2-yl]ethanol is sourced from PubChem (CID 138485490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).