N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine

C11H15N3S — CID 64830566

IUPACN'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine
SMILESCC(NCCN)c1cnc2ccsc2c1
InChIInChI=1S/C11H15N3S/c1-8(13-4-3-12)9-6-11-10(14-7-9)2-5-15-11/h2,5-8,13H,3-4,12H2,1H3
InChIKeyHPOCRXSBQVVRST-UHFFFAOYSA-N
MW221.33 g/mol
LogP1.91
Rot. Bonds4

About N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine

N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine (PubChem CID 64830566) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine
PubChem CID64830566
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC NameN'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine
SMILESCC(NCCN)c1cnc2ccsc2c1
InChIInChI=1S/C11H15N3S/c1-8(13-4-3-12)9-6-11-10(14-7-9)2-5-15-11/h2,5-8,13H,3-4,12H2,1H3
InChIKeyHPOCRXSBQVVRST-UHFFFAOYSA-N
XLogP1.91
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N'-(1-thieno[3,2-b]pyridin-6-ylethyl)propane-1,3-diamine
CID 64830568
N'-(1-thieno[3,2-b]pyridin-6-ylethyl)butane-1,4-diamine
CID 64830758
N-[2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethyl]acetamide
CID 64829172
N-[2-(2-methylpropoxy)ethyl]-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 115713730
3-propan-2-yloxy-N-(1-thieno[3,2-b]pyridin-6-ylethyl)propan-1-amine
CID 64830936
N-(1-thieno[3,2-b]pyridin-6-ylethyl)pent-4-yn-1-amine
CID 103786961
2-(1-thieno[3,2-b]pyridin-6-ylethylamino)acetic acid
CID 64828783
2-bromo-N-(1-thieno[3,2-b]pyridin-6-ylethyl)prop-2-en-1-amine
CID 115717289
N-(2-cyclopentylethyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 64831341
4-[2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethyl]phenol
CID 64830374
N-(2-phenylsulfanylethyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 64829637
N-[(4-methylphenyl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 64828768

Frequently Asked Questions

What is the IUPAC name of N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine?
The IUPAC name of N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine (CID 64830566) is N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine is CC(NCCN)c1cnc2ccsc2c1.
What is the InChIKey of N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine?
The InChIKey is HPOCRXSBQVVRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-8(13-4-3-12)9-6-11-10(14-7-9)2-5-15-11/h2,5-8,13H,3-4,12H2,1H3.
What are the key properties of N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine?
N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine has a molecular weight of 221.33 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine is sourced from PubChem (CID 64830566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).