(2R)-1-(5-phenylthiophen-2-yl)propan-2-amine

C13H15NS — CID 18656702

IUPAC(2R)-1-(5-phenylthiophen-2-yl)propan-2-amine
SMILESC[C@@H](N)Cc1ccc(-c2ccccc2)s1
InChIInChI=1S/C13H15NS/c1-10(14)9-12-7-8-13(15-12)11-5-3-2-4-6-11/h2-8,10H,9,14H2,1H3/t10-/m1/s1
InChIKeyIOUDYORIRJOYKC-SNVBAGLBSA-N
MW217.34 g/mol
LogP3.30
Rot. Bonds3

About (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine

(2R)-1-(5-phenylthiophen-2-yl)propan-2-amine (PubChem CID 18656702) has the molecular formula C13H15NS and a molecular weight of 217.34 g/mol. Its IUPAC name is (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine.

Molecular Properties

Compound Name(2R)-1-(5-phenylthiophen-2-yl)propan-2-amine
PubChem CID18656702
Molecular FormulaC13H15NS
Molecular Weight217.34 g/mol
Exact Mass217.09
IUPAC Name(2R)-1-(5-phenylthiophen-2-yl)propan-2-amine
SMILESC[C@@H](N)Cc1ccc(-c2ccccc2)s1
InChIInChI=1S/C13H15NS/c1-10(14)9-12-7-8-13(15-12)11-5-3-2-4-6-11/h2-8,10H,9,14H2,1H3/t10-/m1/s1
InChIKeyIOUDYORIRJOYKC-SNVBAGLBSA-N
XLogP3.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.34
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-phenylthiophen-2-yl)methanamine
CID 11993875
1-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propan-2-amine
CID 170890943
N-[(5-phenylthiophen-2-yl)methyl]propan-2-amine
CID 43213873
(2R)-1-(5-methylthiophen-2-yl)propan-2-amine
CID 18656698
3-[(5-phenylthiophen-2-yl)methylamino]butan-1-ol
CID 78998187
1-phenyl-N-[(5-phenylthiophen-2-yl)methyl]ethanamine
CID 43222571
λ2-plumbane;1-phenylpropan-2-amine
CID 174896483
2-methyl-N-[(5-phenylthiophen-2-yl)methyl]pentan-3-amine
CID 55191795
3-ethyl-N-[(5-phenylthiophen-2-yl)methyl]pentan-2-amine
CID 63843620
2-(4-chlorophenyl)-5-(2-methylpropyl)thiophene
CID 169286654
azane;1-phenylpropan-2-amine
CID 67350534
N-[(5-phenylthiophen-2-yl)methyl]aniline
CID 43756087

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine?
The IUPAC name of (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine (CID 18656702) is (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine.
What is the SMILES notation for (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine?
The canonical SMILES for (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine is C[C@@H](N)Cc1ccc(-c2ccccc2)s1.
What is the InChIKey of (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine?
The InChIKey is IOUDYORIRJOYKC-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H15NS/c1-10(14)9-12-7-8-13(15-12)11-5-3-2-4-6-11/h2-8,10H,9,14H2,1H3/t10-/m1/s1.
What are the key properties of (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine?
(2R)-1-(5-phenylthiophen-2-yl)propan-2-amine has a molecular weight of 217.34 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(5-phenylthiophen-2-yl)propan-2-amine is sourced from PubChem (CID 18656702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).