(3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride

C7H10ClNO3 — CID 155903198

IUPAC(3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride
SMILESCl.N[C@H](CC(=O)O)c1ccco1
InChIInChI=1S/C7H9NO3.ClH/c8-5(4-7(9)10)6-2-1-3-11-6;/h1-3,5H,4,8H2,(H,9,10);1H/t5-;/m1./s1
InChIKeyOWQPNOKUHDOIBK-NUBCRITNSA-N
MW191.61 g/mol
LogP1.18
Rot. Bonds3

About (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride

(3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride (PubChem CID 155903198) has the molecular formula C7H10ClNO3 and a molecular weight of 191.61 g/mol. Its IUPAC name is (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride.

Molecular Properties

Compound Name(3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride
PubChem CID155903198
Molecular FormulaC7H10ClNO3
Molecular Weight191.61 g/mol
Exact Mass191.03
IUPAC Name(3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride
SMILESCl.N[C@H](CC(=O)O)c1ccco1
InChIInChI=1S/C7H9NO3.ClH/c8-5(4-7(9)10)6-2-1-3-11-6;/h1-3,5H,4,8H2,(H,9,10);1H/t5-;/m1./s1
InChIKeyOWQPNOKUHDOIBK-NUBCRITNSA-N
XLogP1.18
TPSA76.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.61
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-(furan-2-yl)propanoyl iodide
CID 163471239
(5S)-5-amino-5-(furan-2-yl)pentanoic acid
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3-amino-3-(furan-2-yl)-N,N-dimethylpropanamide
CID 82075111
(3S)-3-(furan-2-yl)-3-hydroxypropanoic acid
CID 69050344
(2R)-2-(furan-2-yl)butanedioic acid
CID 919498
(1S)-1-(furan-2-yl)-3-methylbut-3-en-1-amine
CID 131000468
2-amino-2-(furan-2-yl)ethanol
CID 54048773
(1S)-1-(furan-2-yl)propan-1-amine;hydrochloride
CID 11615221
(3S)-3-amino-4-(furan-2-yl)butanoic acid
CID 2761693
(3S)-4,4,4-trifluoro-3-(furan-2-yl)butanoic acid
CID 129375360
(3S)-3-amino-3-(2-aminofuran-3-yl)propanoic acid
CID 130725471
(4S)-4-amino-4-(furan-2-yl)butan-1-ol;hydrochloride
CID 171231726

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride?
The IUPAC name of (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride (CID 155903198) is (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride.
What is the SMILES notation for (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride?
The canonical SMILES for (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride is Cl.N[C@H](CC(=O)O)c1ccco1.
What is the InChIKey of (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride?
The InChIKey is OWQPNOKUHDOIBK-NUBCRITNSA-N. The full InChI is InChI=1S/C7H9NO3.ClH/c8-5(4-7(9)10)6-2-1-3-11-6;/h1-3,5H,4,8H2,(H,9,10);1H/t5-;/m1./s1.
What are the key properties of (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride?
(3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride has a molecular weight of 191.61 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride is sourced from PubChem (CID 155903198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).