5-(5-ethylthiophen-2-yl)pentan-2-amine

C11H19NS — CID 64502698

IUPAC5-(5-ethylthiophen-2-yl)pentan-2-amine
SMILESCCc1ccc(CCCC(C)N)s1
InChIInChI=1S/C11H19NS/c1-3-10-7-8-11(13-10)6-4-5-9(2)12/h7-9H,3-6,12H2,1-2H3
InChIKeyNUAFHNCKUSJOPT-UHFFFAOYSA-N
MW197.35 g/mol
LogP2.98
Rot. Bonds5

About 5-(5-ethylthiophen-2-yl)pentan-2-amine

5-(5-ethylthiophen-2-yl)pentan-2-amine (PubChem CID 64502698) has the molecular formula C11H19NS and a molecular weight of 197.35 g/mol. Its IUPAC name is 5-(5-ethylthiophen-2-yl)pentan-2-amine.

Molecular Properties

Compound Name5-(5-ethylthiophen-2-yl)pentan-2-amine
PubChem CID64502698
Molecular FormulaC11H19NS
Molecular Weight197.35 g/mol
Exact Mass197.12
IUPAC Name5-(5-ethylthiophen-2-yl)pentan-2-amine
SMILESCCc1ccc(CCCC(C)N)s1
InChIInChI=1S/C11H19NS/c1-3-10-7-8-11(13-10)6-4-5-9(2)12/h7-9H,3-6,12H2,1-2H3
InChIKeyNUAFHNCKUSJOPT-UHFFFAOYSA-N
XLogP2.98
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.35
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromopentyl)-5-ethylthiophene
CID 64507801
2-(4-chloroheptyl)-5-ethylthiophene
CID 64516621
2-dodecyl-5-ethylthiophene
CID 528251
2,5-diethylthiophene
CID 521294
2-[2-(5-ethylthiophen-2-yl)ethyl]propane-1,3-diamine
CID 83929368
4-[4-[(5-ethylthiophen-2-yl)methoxy]phenyl]butan-2-amine
CID 60878632
4-(5-ethylthiophen-2-yl)-N-(2-methylpropyl)butan-1-amine
CID 64504459
2-(3-bromopentyl)-5-ethylthiophene
CID 63471038
N-ethyl-1-(5-ethylthiophen-2-yl)hexan-3-amine
CID 60996677
1-(5-ethylthiophen-2-yl)tridecan-2-amine
CID 115842421
4-amino-1-(5-ethylthiophen-2-yl)pentan-2-one
CID 116556032
(1R)-1-(5-ethylthiophen-2-yl)butan-1-amine;hydrochloride
CID 171211735

Frequently Asked Questions

What is the IUPAC name of 5-(5-ethylthiophen-2-yl)pentan-2-amine?
The IUPAC name of 5-(5-ethylthiophen-2-yl)pentan-2-amine (CID 64502698) is 5-(5-ethylthiophen-2-yl)pentan-2-amine.
What is the SMILES notation for 5-(5-ethylthiophen-2-yl)pentan-2-amine?
The canonical SMILES for 5-(5-ethylthiophen-2-yl)pentan-2-amine is CCc1ccc(CCCC(C)N)s1.
What is the InChIKey of 5-(5-ethylthiophen-2-yl)pentan-2-amine?
The InChIKey is NUAFHNCKUSJOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NS/c1-3-10-7-8-11(13-10)6-4-5-9(2)12/h7-9H,3-6,12H2,1-2H3.
What are the key properties of 5-(5-ethylthiophen-2-yl)pentan-2-amine?
5-(5-ethylthiophen-2-yl)pentan-2-amine has a molecular weight of 197.35 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-ethylthiophen-2-yl)pentan-2-amine is sourced from PubChem (CID 64502698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).