3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride

C7H14ClNO2 — CID 71757916

IUPAC3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride
SMILESCl.O=C(O)CC[C@H]1CCCN1
InChIInChI=1S/C7H13NO2.ClH/c9-7(10)4-3-6-2-1-5-8-6;/h6,8H,1-5H2,(H,9,10);1H/t6-;/m1./s1
InChIKeyFDACNBQRVTXPOH-FYZOBXCZSA-N
MW179.65 g/mol
LogP1.02
Rot. Bonds3

About 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride

3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride (PubChem CID 71757916) has the molecular formula C7H14ClNO2 and a molecular weight of 179.65 g/mol. Its IUPAC name is 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride.

Molecular Properties

Compound Name3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride
PubChem CID71757916
Molecular FormulaC7H14ClNO2
Molecular Weight179.65 g/mol
Exact Mass179.07
IUPAC Name3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride
SMILESCl.O=C(O)CC[C@H]1CCCN1
InChIInChI=1S/C7H13NO2.ClH/c9-7(10)4-3-6-2-1-5-8-6;/h6,8H,1-5H2,(H,9,10);1H/t6-;/m1./s1
InChIKeyFDACNBQRVTXPOH-FYZOBXCZSA-N
XLogP1.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.65
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Homoproline, (+)-
CID 2761541
(2R)-2-Pyrrolidineacetic acid
CID 5706675
3-(5-Oxopyrrolidin-2-yl)propanoic acid
CID 4585667
Homoproline, (A+-)-
CID 123784
2-(Pyrrolidin-2-yl)acetic acid hydrochloride
CID 12514707
3-(Piperidin-2-yl)propanoic acid hydrochloride
CID 42614381
3-[(2R)-Pyrrolidin-2-yl]propanoic acid
CID 11528359
3-Pyrrolidin-2-yl-propionic acid
CID 550965
(S)-2-(2-Pyrrolidinyl)acetic acid hydrochloride
CID 2761540
3-[(2S)-pyrrolidin-2-yl]propanoic acid hydrochloride
CID 132398598
3-(1-Methylpyrrolidin-2-yl)propanoic acid hydrochloride
CID 122164179
2-[(2R,4R)-4-fluoropyrrolidin-2-yl]acetic acid hydrochloride
CID 137952315

Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride?
The IUPAC name of 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride (CID 71757916) is 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride.
What is the SMILES notation for 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride?
The canonical SMILES for 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride is Cl.O=C(O)CC[C@H]1CCCN1.
What is the InChIKey of 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride?
The InChIKey is FDACNBQRVTXPOH-FYZOBXCZSA-N. The full InChI is InChI=1S/C7H13NO2.ClH/c9-7(10)4-3-6-2-1-5-8-6;/h6,8H,1-5H2,(H,9,10);1H/t6-;/m1./s1.
What are the key properties of 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride?
3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride has a molecular weight of 179.65 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-pyrrolidin-2-yl]propanoic acid;hydrochloride is sourced from PubChem (CID 71757916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).