pyrrolidin-1-ylmethanol;hydrochloride

C5H12ClNO — CID 68973638

IUPACpyrrolidin-1-ylmethanol;hydrochloride
SMILESCl.OCN1CCCC1
InChIInChI=1S/C5H11NO.ClH/c7-5-6-3-1-2-4-6;/h7H,1-5H2;1H
InChIKeyNULYVKDSWWYDPE-UHFFFAOYSA-N
MW137.61 g/mol
LogP0.45
Rot. Bonds1

About pyrrolidin-1-ylmethanol;hydrochloride

pyrrolidin-1-ylmethanol;hydrochloride (PubChem CID 68973638) has the molecular formula C5H12ClNO and a molecular weight of 137.61 g/mol. Its IUPAC name is pyrrolidin-1-ylmethanol;hydrochloride.

Molecular Properties

Compound Namepyrrolidin-1-ylmethanol;hydrochloride
PubChem CID68973638
Molecular FormulaC5H12ClNO
Molecular Weight137.61 g/mol
Exact Mass137.06
IUPAC Namepyrrolidin-1-ylmethanol;hydrochloride
SMILESCl.OCN1CCCC1
InChIInChI=1S/C5H11NO.ClH/c7-5-6-3-1-2-4-6;/h7H,1-5H2;1H
InChIKeyNULYVKDSWWYDPE-UHFFFAOYSA-N
XLogP0.45
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.61
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanol;[4-(hydroxymethyl)piperazin-1-yl]methanol
CID 69172076
(4-ethylpiperazin-1-yl)methanol;methane
CID 161108744
bis(2-piperidin-1-ylethanol);dihydroiodide
CID 175097300
1-(2-pyrrolidin-1-ylethyl)pyrrolidine
CID 11062806
[4-(2-methylpropyl)piperazin-1-yl]methanol
CID 58575664
propan-1-ol;2-pyrrolidin-1-ylethanol
CID 174908040
methoxymethane;2-pyrrolidin-1-ylethanol
CID 142059876
2-[4-(3-pyrrolidin-1-ylpropyl)piperazin-1-yl]ethanol
CID 62021526
1,3-dipyrrolidin-1-ylpropan-2-ol
CID 57126359
S-(pyrrolidin-1-ylmethyl)thiohydroxylamine
CID 23354513
acetylene;3-piperidin-1-ylpropan-1-ol
CID 162683866
1,4-dithia-8-azaspiro[4.5]decan-8-ylmethanol
CID 90897379

Frequently Asked Questions

What is the IUPAC name of pyrrolidin-1-ylmethanol;hydrochloride?
The IUPAC name of pyrrolidin-1-ylmethanol;hydrochloride (CID 68973638) is pyrrolidin-1-ylmethanol;hydrochloride.
What is the SMILES notation for pyrrolidin-1-ylmethanol;hydrochloride?
The canonical SMILES for pyrrolidin-1-ylmethanol;hydrochloride is Cl.OCN1CCCC1.
What is the InChIKey of pyrrolidin-1-ylmethanol;hydrochloride?
The InChIKey is NULYVKDSWWYDPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.ClH/c7-5-6-3-1-2-4-6;/h7H,1-5H2;1H.
What are the key properties of pyrrolidin-1-ylmethanol;hydrochloride?
pyrrolidin-1-ylmethanol;hydrochloride has a molecular weight of 137.61 g/mol, XLogP of 0.45, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolidin-1-ylmethanol;hydrochloride is sourced from PubChem (CID 68973638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).