[5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride

C10H12ClNO2S — CID 171211493

IUPAC[5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride
SMILESCl.N[C@H](c1ccsc1)c1ccc(CO)o1
InChIInChI=1S/C10H11NO2S.ClH/c11-10(7-3-4-14-6-7)9-2-1-8(5-12)13-9;/h1-4,6,10,12H,5,11H2;1H/t10-;/m1./s1
InChIKeyLQYLMEIEHOAQAD-HNCPQSOCSA-N
MW245.73 g/mol
LogP2.30
Rot. Bonds3

About [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride

[5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride (PubChem CID 171211493) has the molecular formula C10H12ClNO2S and a molecular weight of 245.73 g/mol. Its IUPAC name is [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride.

Molecular Properties

Compound Name[5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride
PubChem CID171211493
Molecular FormulaC10H12ClNO2S
Molecular Weight245.73 g/mol
Exact Mass245.03
IUPAC Name[5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride
SMILESCl.N[C@H](c1ccsc1)c1ccc(CO)o1
InChIInChI=1S/C10H11NO2S.ClH/c11-10(7-3-4-14-6-7)9-2-1-8(5-12)13-9;/h1-4,6,10,12H,5,11H2;1H/t10-;/m1./s1
InChIKeyLQYLMEIEHOAQAD-HNCPQSOCSA-N
XLogP2.30
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.73
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(S)-(5-ethylfuran-2-yl)-thiophen-3-ylmethanamine
CID 94398939
(5-thiophen-3-ylfuran-2-yl)methanol
CID 19744465
[5-[(1R)-1-amino-2,2-dimethylpropyl]furan-2-yl]methanol;hydrochloride
CID 171250266
[5-[(1S)-1,3-diaminopropyl]furan-2-yl]methanol
CID 171231063
(3R)-3-amino-3-thiophen-3-ylpropan-1-ol
CID 1487793
2-[(S)-amino(thiophen-3-yl)methyl]benzene-1,3,5-triol;hydrochloride
CID 171217050
[5-[(1S)-1-aminobutyl]furan-2-yl]methanol;hydrochloride
CID 171231073
1-(5-ethylfuran-2-yl)-N-methyl-1-thiophen-3-ylmethanamine
CID 62345338
4-[(R)-amino(thiophen-3-yl)methyl]-3-fluorophenol;hydrochloride
CID 171218710
4-[(S)-amino(thiophen-3-yl)methyl]-3-fluorophenol;hydrochloride
CID 171199193
(S)-(2,3,4,5,6-pentafluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171210314
(1R,2S)-1-amino-1-[5-(hydroxymethyl)furan-2-yl]propan-2-ol
CID 130739101

Frequently Asked Questions

What is the IUPAC name of [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride?
The IUPAC name of [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride (CID 171211493) is [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride.
What is the SMILES notation for [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride?
The canonical SMILES for [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride is Cl.N[C@H](c1ccsc1)c1ccc(CO)o1.
What is the InChIKey of [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride?
The InChIKey is LQYLMEIEHOAQAD-HNCPQSOCSA-N. The full InChI is InChI=1S/C10H11NO2S.ClH/c11-10(7-3-4-14-6-7)9-2-1-8(5-12)13-9;/h1-4,6,10,12H,5,11H2;1H/t10-;/m1./s1.
What are the key properties of [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride?
[5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride has a molecular weight of 245.73 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(R)-amino(thiophen-3-yl)methyl]furan-2-yl]methanol;hydrochloride is sourced from PubChem (CID 171211493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).