N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine

C14H19N3OS — CID 43522796

IUPACN-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine
SMILESc1cc2sccc2c(NCCCN2CCOCC2)n1
InChIInChI=1S/C14H19N3OS/c1(6-17-7-9-18-10-8-17)4-15-14-12-3-11-19-13(12)2-5-16-14/h2-3,5,11H,1,4,6-10H2,(H,15,16)
InChIKeyYBAZZGZQARTRDU-UHFFFAOYSA-N
MW277.39 g/mol
LogP2.43
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine

N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine (PubChem CID 43522796) has the molecular formula C14H19N3OS and a molecular weight of 277.39 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine
PubChem CID43522796
Molecular FormulaC14H19N3OS
Molecular Weight277.39 g/mol
Exact Mass277.12
IUPAC NameN-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine
SMILESc1cc2sccc2c(NCCCN2CCOCC2)n1
InChIInChI=1S/C14H19N3OS/c1(6-17-7-9-18-10-8-17)4-15-14-12-3-11-19-13(12)2-5-16-14/h2-3,5,11H,1,4,6-10H2,(H,15,16)
InChIKeyYBAZZGZQARTRDU-UHFFFAOYSA-N
XLogP2.43
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine (CID 43522796) is N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine is c1cc2sccc2c(NCCCN2CCOCC2)n1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine?
The InChIKey is YBAZZGZQARTRDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3OS/c1(6-17-7-9-18-10-8-17)4-15-14-12-3-11-19-13(12)2-5-16-14/h2-3,5,11H,1,4,6-10H2,(H,15,16).
What are the key properties of N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine?
N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine has a molecular weight of 277.39 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 43522796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).