phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride

C11H16ClNO — CID 68687169

IUPACphenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
SMILESCl.OC(c1ccccc1)[C@H]1CCCN1
InChIInChI=1S/C11H15NO.ClH/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9;/h1-3,5-6,10-13H,4,7-8H2;1H/t10-,11?;/m1./s1
InChIKeyCGQHPZOHYDIWLB-QUUNXCOLSA-N
MW213.71 g/mol
LogP1.89
Rot. Bonds2

About phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride

phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride (PubChem CID 68687169) has the molecular formula C11H16ClNO and a molecular weight of 213.71 g/mol. Its IUPAC name is phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride.

Molecular Properties

Compound Namephenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
PubChem CID68687169
Molecular FormulaC11H16ClNO
Molecular Weight213.71 g/mol
Exact Mass213.09
IUPAC Namephenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
SMILESCl.OC(c1ccccc1)[C@H]1CCCN1
InChIInChI=1S/C11H15NO.ClH/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9;/h1-3,5-6,10-13H,4,7-8H2;1H/t10-,11?;/m1./s1
InChIKeyCGQHPZOHYDIWLB-QUUNXCOLSA-N
XLogP1.89
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-diphenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 118229705
2,2-diphenyl-1-pyrrolidin-2-ylethanol
CID 69294076
2,2-diphenyl-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 68647594
(S)-(4-methylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 39238470
(S)-(4-tert-butylphenyl)-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
CID 135313112
3-[hydroxy(pyrrolidin-2-yl)methyl]phenol
CID 83484257
ethane;(4-methylphenyl)-pyrrolidin-2-ylmethanol
CID 142507494
pyridin-3-yl(pyrrolidin-2-yl)methanol
CID 22605701
(2R)-2-[(1R)-1-phenylethyl]pyrrolidine
CID 95732426
(2-methylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 164654197
2-(1-phenylpropyl)pyrrolidine;hydrochloride
CID 17389655
1,1,5,5-tetraphenyl-2,4-di(piperidin-2-yl)pentan-3-one;hydrochloride
CID 174956576

Frequently Asked Questions

What is the IUPAC name of phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride?
The IUPAC name of phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride (CID 68687169) is phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride.
What is the SMILES notation for phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride?
The canonical SMILES for phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride is Cl.OC(c1ccccc1)[C@H]1CCCN1.
What is the InChIKey of phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride?
The InChIKey is CGQHPZOHYDIWLB-QUUNXCOLSA-N. The full InChI is InChI=1S/C11H15NO.ClH/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9;/h1-3,5-6,10-13H,4,7-8H2;1H/t10-,11?;/m1./s1.
What are the key properties of phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride?
phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride has a molecular weight of 213.71 g/mol, XLogP of 1.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride is sourced from PubChem (CID 68687169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).