(3R)-3-phenylpyrrolidin-3-ol;hydrochloride

C10H14ClNO — CID 154574670

IUPAC(3R)-3-phenylpyrrolidin-3-ol;hydrochloride
SMILESCl.O[C@@]1(c2ccccc2)CCNC1
InChIInChI=1S/C10H13NO.ClH/c12-10(6-7-11-8-10)9-4-2-1-3-5-9;/h1-5,11-12H,6-8H2;1H/t10-;/m0./s1
InChIKeyTXWWLCQBZZBGQW-PPHPATTJSA-N
MW199.68 g/mol
LogP1.29
Rot. Bonds1

About (3R)-3-phenylpyrrolidin-3-ol;hydrochloride

(3R)-3-phenylpyrrolidin-3-ol;hydrochloride (PubChem CID 154574670) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is (3R)-3-phenylpyrrolidin-3-ol;hydrochloride.

Molecular Properties

Compound Name(3R)-3-phenylpyrrolidin-3-ol;hydrochloride
PubChem CID154574670
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC Name(3R)-3-phenylpyrrolidin-3-ol;hydrochloride
SMILESCl.O[C@@]1(c2ccccc2)CCNC1
InChIInChI=1S/C10H13NO.ClH/c12-10(6-7-11-8-10)9-4-2-1-3-5-9;/h1-5,11-12H,6-8H2;1H/t10-;/m0./s1
InChIKeyTXWWLCQBZZBGQW-PPHPATTJSA-N
XLogP1.29
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-(4-chlorophenyl)pyrrolidin-3-ol
CID 92967135
4-(4-benzylphenyl)piperidin-4-ol
CID 15057300
copper;1-phenylcyclohexan-1-ol
CID 174727157
3-methyl-3-phenylpyrrolidine
CID 21098616
4-(4-phenylphenyl)azepan-4-ol
CID 103982949
3-(4-fluorophenyl)piperidin-3-ol
CID 10198053
1-[3-(3-hydroxypyrrolidin-3-yl)phenyl]prop-2-en-1-one
CID 122456440
(3S)-3-(6-methyl-3-pyridinyl)pyrrolidin-3-ol
CID 124508626
ethane;1-phenylcyclohexan-1-ol
CID 144640846
3-benzylpyrrolidin-3-ol;hydrochloride
CID 122508012
3-(4-aminophenyl)piperidin-3-ol
CID 83878179
3-phenylazetidin-3-ol;2,2,2-trifluoroacetic acid
CID 66988147

Frequently Asked Questions

What is the IUPAC name of (3R)-3-phenylpyrrolidin-3-ol;hydrochloride?
The IUPAC name of (3R)-3-phenylpyrrolidin-3-ol;hydrochloride (CID 154574670) is (3R)-3-phenylpyrrolidin-3-ol;hydrochloride.
What is the SMILES notation for (3R)-3-phenylpyrrolidin-3-ol;hydrochloride?
The canonical SMILES for (3R)-3-phenylpyrrolidin-3-ol;hydrochloride is Cl.O[C@@]1(c2ccccc2)CCNC1.
What is the InChIKey of (3R)-3-phenylpyrrolidin-3-ol;hydrochloride?
The InChIKey is TXWWLCQBZZBGQW-PPHPATTJSA-N. The full InChI is InChI=1S/C10H13NO.ClH/c12-10(6-7-11-8-10)9-4-2-1-3-5-9;/h1-5,11-12H,6-8H2;1H/t10-;/m0./s1.
What are the key properties of (3R)-3-phenylpyrrolidin-3-ol;hydrochloride?
(3R)-3-phenylpyrrolidin-3-ol;hydrochloride has a molecular weight of 199.68 g/mol, XLogP of 1.29, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-phenylpyrrolidin-3-ol;hydrochloride is sourced from PubChem (CID 154574670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).