2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol

C12H16N2OS — CID 61425977

IUPAC2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol
SMILESCCCN(CCO)c1nccc2sccc12
InChIInChI=1S/C12H16N2OS/c1-2-6-14(7-8-15)12-10-4-9-16-11(10)3-5-13-12/h3-5,9,15H,2,6-8H2,1H3
InChIKeyBLNAWUAVOWIWBR-UHFFFAOYSA-N
MW236.34 g/mol
LogP2.51
Rot. Bonds5

About 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol

2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol (PubChem CID 61425977) has the molecular formula C12H16N2OS and a molecular weight of 236.34 g/mol. Its IUPAC name is 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol
PubChem CID61425977
Molecular FormulaC12H16N2OS
Molecular Weight236.34 g/mol
Exact Mass236.10
IUPAC Name2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol
SMILESCCCN(CCO)c1nccc2sccc12
InChIInChI=1S/C12H16N2OS/c1-2-6-14(7-8-15)12-10-4-9-16-11(10)3-5-13-12/h3-5,9,15H,2,6-8H2,1H3
InChIKeyBLNAWUAVOWIWBR-UHFFFAOYSA-N
XLogP2.51
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[propyl(1,3-thiazol-2-yl)amino]ethanol
CID 61425727
N'-(2-methylpropyl)-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
CID 62587629
2-[(5-methoxyisoquinolin-1-yl)-propylamino]ethanol
CID 106541421
2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol
CID 62734185
N-(1-bromopropan-2-yl)-N-methylthieno[3,2-c]pyridin-4-amine
CID 104555303
N-(2-chloroethyl)-N-(2,2-difluoroethyl)thieno[3,2-c]pyridin-4-amine
CID 107490070
4-[methyl(thieno[3,2-c]pyridin-4-yl)amino]butanoic acid
CID 43522697
2-[(5-bromoisoquinolin-1-yl)-butylamino]ethanol
CID 106541425
3-methyl-3-(thieno[3,2-c]pyridin-4-ylamino)pentan-1-ol
CID 106171144
N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine
CID 60923008
2-[2-hydroxyethyl(propyl)amino]-3-nitropyridine-4-carbonitrile
CID 82812716
N-(2-methoxyethyl)-N'-methyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
CID 62586554

Frequently Asked Questions

What is the IUPAC name of 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol?
The IUPAC name of 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol (CID 61425977) is 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol?
The canonical SMILES for 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol is CCCN(CCO)c1nccc2sccc12.
What is the InChIKey of 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol?
The InChIKey is BLNAWUAVOWIWBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2OS/c1-2-6-14(7-8-15)12-10-4-9-16-11(10)3-5-13-12/h3-5,9,15H,2,6-8H2,1H3.
What are the key properties of 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol?
2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol has a molecular weight of 236.34 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[propyl(thieno[3,2-c]pyridin-4-yl)amino]ethanol is sourced from PubChem (CID 61425977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).