2-pyrrolidin-3-ylethanol;hydrochloride

C6H14ClNO — CID 23079943

IUPAC2-pyrrolidin-3-ylethanol;hydrochloride
SMILESCl.OCCC1CCNC1
InChIInChI=1S/C6H13NO.ClH/c8-4-2-6-1-3-7-5-6;/h6-8H,1-5H2;1H
InChIKeySVUPXZZFQCQRSC-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.40
Rot. Bonds2

About 2-pyrrolidin-3-ylethanol;hydrochloride

2-pyrrolidin-3-ylethanol;hydrochloride (PubChem CID 23079943) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is 2-pyrrolidin-3-ylethanol;hydrochloride.

Molecular Properties

Compound Name2-pyrrolidin-3-ylethanol;hydrochloride
PubChem CID23079943
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name2-pyrrolidin-3-ylethanol;hydrochloride
SMILESCl.OCCC1CCNC1
InChIInChI=1S/C6H13NO.ClH/c8-4-2-6-1-3-7-5-6;/h6-8H,1-5H2;1H
InChIKeySVUPXZZFQCQRSC-UHFFFAOYSA-N
XLogP0.40
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-3-ylethanol;hydrochloride?
The IUPAC name of 2-pyrrolidin-3-ylethanol;hydrochloride (CID 23079943) is 2-pyrrolidin-3-ylethanol;hydrochloride.
What is the SMILES notation for 2-pyrrolidin-3-ylethanol;hydrochloride?
The canonical SMILES for 2-pyrrolidin-3-ylethanol;hydrochloride is Cl.OCCC1CCNC1.
What is the InChIKey of 2-pyrrolidin-3-ylethanol;hydrochloride?
The InChIKey is SVUPXZZFQCQRSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c8-4-2-6-1-3-7-5-6;/h6-8H,1-5H2;1H.
What are the key properties of 2-pyrrolidin-3-ylethanol;hydrochloride?
2-pyrrolidin-3-ylethanol;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-3-ylethanol;hydrochloride is sourced from PubChem (CID 23079943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).