N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine

C15H19NS — CID 43288007

IUPACN-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine
SMILESCCNC(CC)c1ccc(-c2ccccc2)s1
InChIInChI=1S/C15H19NS/c1-3-13(16-4-2)15-11-10-14(17-15)12-8-6-5-7-9-12/h5-11,13,16H,3-4H2,1-2H3
InChIKeyNPMWSKRCXXDOJG-UHFFFAOYSA-N
MW245.39 g/mol
LogP4.48
Rot. Bonds5

About N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine

N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine (PubChem CID 43288007) has the molecular formula C15H19NS and a molecular weight of 245.39 g/mol. Its IUPAC name is N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine
PubChem CID43288007
Molecular FormulaC15H19NS
Molecular Weight245.39 g/mol
Exact Mass245.12
IUPAC NameN-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine
SMILESCCNC(CC)c1ccc(-c2ccccc2)s1
InChIInChI=1S/C15H19NS/c1-3-13(16-4-2)15-11-10-14(17-15)12-8-6-5-7-9-12/h5-11,13,16H,3-4H2,1-2H3
InChIKeyNPMWSKRCXXDOJG-UHFFFAOYSA-N
XLogP4.48
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.39
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(3,5-dichloro-4-fluorophenyl)thiophen-2-yl]-N-ethylpropan-1-amine
CID 107577037
1-[5-(4-methylphenyl)thiophen-2-yl]-N-propylpropan-1-amine
CID 43287473
N-ethyl-1-[5-(4-methylphenyl)thiophen-2-yl]butan-1-amine
CID 43287471
1-[5-(3-bromophenyl)thiophen-2-yl]-N-propylpropan-1-amine
CID 43288036
1-[5-(4-chloro-3-fluorophenyl)thiophen-2-yl]-N-ethylpropan-1-amine
CID 63400821
N-ethyl-1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine
CID 62635651
N-ethyl-1-[5-(4-ethylphenyl)thiophen-2-yl]butan-1-amine
CID 43287717
1-[5-(1,3-benzothiazol-6-yl)thiophen-2-yl]-N-ethylpropan-1-amine
CID 107806474
1-[5-(2,5-difluoro-4-methylphenyl)thiophen-2-yl]-N-ethylpropan-1-amine
CID 103586914
1-[5-(4-chlorophenyl)thiophen-2-yl]-N-methylpropan-1-amine
CID 43287778
N-methyl-1-(5-phenylthiophen-2-yl)ethanamine
CID 43288011
1-[5-(4-bromo-2-chlorophenyl)thiophen-2-yl]-N-ethylpropan-1-amine
CID 43288275

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine?
The IUPAC name of N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine (CID 43288007) is N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine is CCNC(CC)c1ccc(-c2ccccc2)s1.
What is the InChIKey of N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine?
The InChIKey is NPMWSKRCXXDOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NS/c1-3-13(16-4-2)15-11-10-14(17-15)12-8-6-5-7-9-12/h5-11,13,16H,3-4H2,1-2H3.
What are the key properties of N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine?
N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine has a molecular weight of 245.39 g/mol, XLogP of 4.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-phenylthiophen-2-yl)propan-1-amine is sourced from PubChem (CID 43288007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).