N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine

C14H19N3S — CID 62587639

IUPACN'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
SMILESNCCN(c1nccc2sccc12)C1CCCC1
InChIInChI=1S/C14H19N3S/c15-7-9-17(11-3-1-2-4-11)14-12-6-10-18-13(12)5-8-16-14/h5-6,8,10-11H,1-4,7,9,15H2
InChIKeyJCTZOSJSBPAXKD-UHFFFAOYSA-N
MW261.39 g/mol
LogP3.00
Rot. Bonds4

About N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine

N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine (PubChem CID 62587639) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
PubChem CID62587639
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC NameN'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
SMILESNCCN(c1nccc2sccc12)C1CCCC1
InChIInChI=1S/C14H19N3S/c15-7-9-17(11-3-1-2-4-11)14-12-6-10-18-13(12)5-8-16-14/h5-6,8,10-11H,1-4,7,9,15H2
InChIKeyJCTZOSJSBPAXKD-UHFFFAOYSA-N
XLogP3.00
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-cycloheptyl-N'-thieno[3,2-c]pyridin-4-ylpropane-1,3-diamine
CID 60868924
N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine
CID 106641172
N'-(2-methylpropyl)-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
CID 62587629
N'-phenyl-N'-thieno[3,2-c]pyridin-4-ylpropane-1,3-diamine
CID 60870418
N'-cyclopropyl-N'-([1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethane-1,2-diamine
CID 106543337
2-[cyclohexyl(thieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 54999057
N'-cyclopentyl-N'-[4-(trifluoromethyl)-2-pyridinyl]ethane-1,2-diamine
CID 66330875
N'-(5-bromoisoquinolin-1-yl)-N'-cyclobutylpropane-1,3-diamine
CID 106543638
N'-cyclopentyl-N'-(6-ethylthieno[2,3-d]pyrimidin-4-yl)ethane-1,2-diamine
CID 62588172
N'-(7-chloroquinolin-4-yl)-N'-cyclopentylethane-1,2-diamine
CID 62586557
N-[[4-(aminomethyl)phenyl]methyl]-N-methylthieno[3,2-c]pyridin-4-amine
CID 60923008
N'-cyclopentyl-N'-(3,6-dimethylpyrazin-2-yl)ethane-1,2-diamine
CID 55218668

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine (CID 62587639) is N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine is NCCN(c1nccc2sccc12)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine?
The InChIKey is JCTZOSJSBPAXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c15-7-9-17(11-3-1-2-4-11)14-12-6-10-18-13(12)5-8-16-14/h5-6,8,10-11H,1-4,7,9,15H2.
What are the key properties of N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine?
N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine has a molecular weight of 261.39 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine is sourced from PubChem (CID 62587639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).