(1R)-1-(3-methylthiophen-2-yl)pentan-1-amine

C10H17NS — CID 55276293

IUPAC(1R)-1-(3-methylthiophen-2-yl)pentan-1-amine
SMILESCCCC[C@@H](N)c1sccc1C
InChIInChI=1S/C10H17NS/c1-3-4-5-9(11)10-8(2)6-7-12-10/h6-7,9H,3-5,11H2,1-2H3/t9-/m1/s1
InChIKeyPPARHWUSNNVFDT-SECBINFHSA-N
MW183.32 g/mol
LogP3.25
Rot. Bonds4

About (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine

(1R)-1-(3-methylthiophen-2-yl)pentan-1-amine (PubChem CID 55276293) has the molecular formula C10H17NS and a molecular weight of 183.32 g/mol. Its IUPAC name is (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine.

Molecular Properties

Compound Name(1R)-1-(3-methylthiophen-2-yl)pentan-1-amine
PubChem CID55276293
Molecular FormulaC10H17NS
Molecular Weight183.32 g/mol
Exact Mass183.11
IUPAC Name(1R)-1-(3-methylthiophen-2-yl)pentan-1-amine
SMILESCCCC[C@@H](N)c1sccc1C
InChIInChI=1S/C10H17NS/c1-3-4-5-9(11)10-8(2)6-7-12-10/h6-7,9H,3-5,11H2,1-2H3/t9-/m1/s1
InChIKeyPPARHWUSNNVFDT-SECBINFHSA-N
XLogP3.25
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.32
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-methylthiophen-2-yl)hexan-1-amine;hydrochloride
CID 86262849
(1S)-1-(3-methylthiophen-2-yl)pentane-1,5-diamine
CID 171222710
(1S)-4-methyl-1-(3-methylthiophen-2-yl)pentan-1-amine;hydrochloride
CID 171222736
1-(3-methylthiophen-2-yl)pentylhydrazine
CID 105245717
(1S)-4,4,4-trifluoro-1-(3-methylthiophen-2-yl)butan-1-amine;hydrochloride
CID 171222723
1-(3-ethylthiophen-2-yl)hexan-1-amine
CID 115837119
1-(3-bromothiophen-2-yl)tridecan-1-amine
CID 115846566
1-(3-chlorothiophen-2-yl)heptan-1-amine
CID 114752614
(3S)-3-amino-3-(3-methylthiophen-2-yl)propanenitrile;hydrochloride
CID 171259927
(1R)-1-(3-methylthiophen-2-yl)but-3-en-1-amine;hydrochloride
CID 171203150
1-(3-methylthiophen-2-yl)tridecan-1-ol
CID 65148369
1-(3-methylthiophen-2-yl)-4-piperazin-1-ylbutan-1-amine
CID 116942064

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine?
The IUPAC name of (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine (CID 55276293) is (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine.
What is the SMILES notation for (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine?
The canonical SMILES for (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine is CCCC[C@@H](N)c1sccc1C.
What is the InChIKey of (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine?
The InChIKey is PPARHWUSNNVFDT-SECBINFHSA-N. The full InChI is InChI=1S/C10H17NS/c1-3-4-5-9(11)10-8(2)6-7-12-10/h6-7,9H,3-5,11H2,1-2H3/t9-/m1/s1.
What are the key properties of (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine?
(1R)-1-(3-methylthiophen-2-yl)pentan-1-amine has a molecular weight of 183.32 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(3-methylthiophen-2-yl)pentan-1-amine is sourced from PubChem (CID 55276293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).