2-(5-thiophen-2-ylpentylamino)ethanol

C11H19NOS — CID 83980456

IUPAC2-(5-thiophen-2-ylpentylamino)ethanol
SMILESOCCNCCCCCc1cccs1
InChIInChI=1S/C11H19NOS/c13-9-8-12-7-3-1-2-5-11-6-4-10-14-11/h4,6,10,12-13H,1-3,5,7-9H2
InChIKeyMMKIFXGVZSIFRL-UHFFFAOYSA-N
MW213.35 g/mol
LogP2.04
Rot. Bonds8

About 2-(5-thiophen-2-ylpentylamino)ethanol

2-(5-thiophen-2-ylpentylamino)ethanol (PubChem CID 83980456) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is 2-(5-thiophen-2-ylpentylamino)ethanol.

Molecular Properties

Compound Name2-(5-thiophen-2-ylpentylamino)ethanol
PubChem CID83980456
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC Name2-(5-thiophen-2-ylpentylamino)ethanol
SMILESOCCNCCCCCc1cccs1
InChIInChI=1S/C11H19NOS/c13-9-8-12-7-3-1-2-5-11-6-4-10-14-11/h4,6,10,12-13H,1-3,5,7-9H2
InChIKeyMMKIFXGVZSIFRL-UHFFFAOYSA-N
XLogP2.04
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butyl-5-thiophen-2-ylpentan-1-amine
CID 83980454
10-thiophen-2-yldecan-1-ol
CID 22992199
N-butyl-4-thiophen-2-ylbutan-1-amine
CID 60984563
N-ethyl-6-thiophen-2-ylhexan-1-amine
CID 65308427
2-[3-(thiophen-2-ylmethylamino)propylamino]ethanol;dihydrochloride
CID 17213960
3-thiophen-2-ylpropan-1-ol
CID 13109866
N'-tert-butyl-N-(4-thiophen-2-ylbutyl)propane-1,3-diamine
CID 113410415
4-thiophen-2-yl-N-(2,2,2-trifluoroethyl)butan-1-amine
CID 60998116
2-(6-thiophen-2-ylhexan-2-ylamino)ethanol
CID 83980461
N-propan-2-yl-6-thiophen-2-ylhexan-1-amine
CID 65308474
5-(2-thiophen-2-ylethylamino)pentanoic acid
CID 103235534
2-(5-thiophen-2-ylpentan-2-ylamino)ethanol
CID 83980472

Frequently Asked Questions

What is the IUPAC name of 2-(5-thiophen-2-ylpentylamino)ethanol?
The IUPAC name of 2-(5-thiophen-2-ylpentylamino)ethanol (CID 83980456) is 2-(5-thiophen-2-ylpentylamino)ethanol.
What is the SMILES notation for 2-(5-thiophen-2-ylpentylamino)ethanol?
The canonical SMILES for 2-(5-thiophen-2-ylpentylamino)ethanol is OCCNCCCCCc1cccs1.
What is the InChIKey of 2-(5-thiophen-2-ylpentylamino)ethanol?
The InChIKey is MMKIFXGVZSIFRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c13-9-8-12-7-3-1-2-5-11-6-4-10-14-11/h4,6,10,12-13H,1-3,5,7-9H2.
What are the key properties of 2-(5-thiophen-2-ylpentylamino)ethanol?
2-(5-thiophen-2-ylpentylamino)ethanol has a molecular weight of 213.35 g/mol, XLogP of 2.04, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-thiophen-2-ylpentylamino)ethanol is sourced from PubChem (CID 83980456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).