(1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride

C7H12ClNS — CID 171210593

IUPAC(1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride
SMILESCC[C@@H](N)c1ccsc1.Cl
InChIInChI=1S/C7H11NS.ClH/c1-2-7(8)6-3-4-9-5-6;/h3-5,7H,2,8H2,1H3;1H/t7-;/m1./s1
InChIKeyXNCKLBRRQKRSAO-OGFXRTJISA-N
MW177.70 g/mol
LogP2.58
Rot. Bonds2

About (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride

(1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride (PubChem CID 171210593) has the molecular formula C7H12ClNS and a molecular weight of 177.70 g/mol. Its IUPAC name is (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride.

Molecular Properties

Compound Name(1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride
PubChem CID171210593
Molecular FormulaC7H12ClNS
Molecular Weight177.70 g/mol
Exact Mass177.04
IUPAC Name(1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride
SMILESCC[C@@H](N)c1ccsc1.Cl
InChIInChI=1S/C7H11NS.ClH/c1-2-7(8)6-3-4-9-5-6;/h3-5,7H,2,8H2,1H3;1H/t7-;/m1./s1
InChIKeyXNCKLBRRQKRSAO-OGFXRTJISA-N
XLogP2.58
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.70
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-3-ethyl-1-thiophen-3-ylpentan-1-amine
CID 99621448
1-thiophen-3-ylhexan-1-amine;hydrochloride
CID 86262846
(1S)-3,3-difluoro-1-thiophen-3-ylpropan-1-amine;hydrochloride
CID 171313205
methyl (3R)-3-amino-3-thiophen-3-ylpropanoate;hydrochloride
CID 171249952
(1S,2R)-1-amino-1-thiophen-3-ylbutan-2-ol
CID 130683153
3-methylidene-1-thiophen-3-ylpentan-1-amine
CID 66044101
(3R)-3-amino-3-thiophen-3-ylpropan-1-ol
CID 1487793
ethyl (3S)-3-amino-3-thiophen-3-ylpropanoate
CID 29059787
3-amino-3-thiophen-3-ylpropanenitrile
CID 55293748
(1S)-3,3,3-trifluoro-1-thiophen-3-ylpropan-1-amine
CID 55296383
2-(3,5-dimethylphenyl)-1-thiophen-3-ylethanamine
CID 61028896
2-cyclopropyl-1-thiophen-3-ylethanamine
CID 55293747

Frequently Asked Questions

What is the IUPAC name of (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride?
The IUPAC name of (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride (CID 171210593) is (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride.
What is the SMILES notation for (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride?
The canonical SMILES for (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride is CC[C@@H](N)c1ccsc1.Cl.
What is the InChIKey of (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride?
The InChIKey is XNCKLBRRQKRSAO-OGFXRTJISA-N. The full InChI is InChI=1S/C7H11NS.ClH/c1-2-7(8)6-3-4-9-5-6;/h3-5,7H,2,8H2,1H3;1H/t7-;/m1./s1.
What are the key properties of (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride?
(1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride has a molecular weight of 177.70 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-thiophen-3-ylpropan-1-amine;hydrochloride is sourced from PubChem (CID 171210593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).