4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine

C16H22N4OS — CID 121395999

IUPAC4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine
SMILESc1cc2cc(CN3CCNCC3)sc2c(N2CCOCC2)n1
InChIInChI=1S/C16H22N4OS/c1-2-18-16(20-7-9-21-10-8-20)15-13(1)11-14(22-15)12-19-5-3-17-4-6-19/h1-2,11,17H,3-10,12H2
InChIKeyOXYDNPHJBSHMHH-UHFFFAOYSA-N
MW318.45 g/mol
LogP1.54
Rot. Bonds3

About 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine

4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine (PubChem CID 121395999) has the molecular formula C16H22N4OS and a molecular weight of 318.45 g/mol. Its IUPAC name is 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine.

Molecular Properties

Compound Name4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine
PubChem CID121395999
Molecular FormulaC16H22N4OS
Molecular Weight318.45 g/mol
Exact Mass318.15
IUPAC Name4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine
SMILESc1cc2cc(CN3CCNCC3)sc2c(N2CCOCC2)n1
InChIInChI=1S/C16H22N4OS/c1-2-18-16(20-7-9-21-10-8-20)15-13(1)11-14(22-15)12-19-5-3-17-4-6-19/h1-2,11,17H,3-10,12H2
InChIKeyOXYDNPHJBSHMHH-UHFFFAOYSA-N
XLogP1.54
TPSA40.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.45
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methanethiol;3-[7-morpholin-4-yl-2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-5-yl]aniline
CID 145097074
3-[4-morpholin-4-yl-6-(piperazin-1-ylmethyl)thieno[3,2-d]pyrimidin-2-yl]phenol;hydrochloride
CID 67054453
2-[[5-[4-morpholin-4-yl-6-(piperazin-1-ylmethyl)thieno[3,2-d]pyrimidin-2-yl]-2-pyridinyl]amino]ethanol
CID 66934280
4-[2-(5-fluoro-1H-indol-4-yl)-6-(piperazin-1-ylmethyl)thieno[3,2-d]pyrimidin-4-yl]morpholine
CID 24937384
4-[2-(6-fluoro-1H-indol-4-yl)-6-(piperazin-1-ylmethyl)thieno[3,2-d]pyrimidin-4-yl]morpholine
CID 24937383
5-[4-morpholin-4-yl-6-(piperazin-1-ylmethyl)thieno[3,2-d]pyrimidin-2-yl]pyridine-3-carbonitrile
CID 66934265
[2-(piperazin-1-ylmethyl)-1-benzothiophen-7-yl]methanamine
CID 117183148
1-[[7-(trifluoromethyl)-1-benzothiophen-2-yl]methyl]piperazine
CID 117196518
4-[2-(1H-indol-4-yl)-6-(piperazin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]morpholine
CID 24938019
4-[(7-bromo-1-benzothiophen-2-yl)methyl]morpholine
CID 117183219
methoxymethane;4-[6-(piperazin-1-ylmethyl)-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholine
CID 143572067
4-[2-(2,4-dimethoxypyrimidin-5-yl)-6-(piperazin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]morpholine
CID 70306461

Frequently Asked Questions

What is the IUPAC name of 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine?
The IUPAC name of 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine (CID 121395999) is 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine.
What is the SMILES notation for 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine?
The canonical SMILES for 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine is c1cc2cc(CN3CCNCC3)sc2c(N2CCOCC2)n1.
What is the InChIKey of 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine?
The InChIKey is OXYDNPHJBSHMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4OS/c1-2-18-16(20-7-9-21-10-8-20)15-13(1)11-14(22-15)12-19-5-3-17-4-6-19/h1-2,11,17H,3-10,12H2.
What are the key properties of 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine?
4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine has a molecular weight of 318.45 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(piperazin-1-ylmethyl)thieno[2,3-c]pyridin-7-yl]morpholine is sourced from PubChem (CID 121395999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).