2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine

C18H19N3OS — CID 163435159

IUPAC2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine
SMILESNc1ccnc2cc(-c3ccc(CN4CCOCC4)cc3)sc12
InChIInChI=1S/C18H19N3OS/c19-15-5-6-20-16-11-17(23-18(15)16)14-3-1-13(2-4-14)12-21-7-9-22-10-8-21/h1-6,11H,7-10,12H2,(H2,19,20)
InChIKeyATWAVIOXVRMJGN-UHFFFAOYSA-N
MW325.44 g/mol
LogP3.38
Rot. Bonds3

About 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine

2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine (PubChem CID 163435159) has the molecular formula C18H19N3OS and a molecular weight of 325.44 g/mol. Its IUPAC name is 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine.

Molecular Properties

Compound Name2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine
PubChem CID163435159
Molecular FormulaC18H19N3OS
Molecular Weight325.44 g/mol
Exact Mass325.12
IUPAC Name2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine
SMILESNc1ccnc2cc(-c3ccc(CN4CCOCC4)cc3)sc12
InChIInChI=1S/C18H19N3OS/c19-15-5-6-20-16-11-17(23-18(15)16)14-3-1-13(2-4-14)12-21-7-9-22-10-8-21/h1-6,11H,7-10,12H2,(H2,19,20)
InChIKeyATWAVIOXVRMJGN-UHFFFAOYSA-N
XLogP3.38
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.44
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]thieno[3,2-b]pyridin-7-amine
CID 89438907
2-[6-(4-chlorophenyl)-4-oxothieno[3,2-d]pyrimidin-3-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 24629730
[4-[[4-[4-[(2-hydroxy-1-phenylethyl)amino]thieno[3,2-d]pyrimidin-6-yl]phenyl]methyl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 78110912
N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-d]pyrimidin-4-amine
CID 127034784
4-[[4-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methyl]morpholine
CID 44588214
[3-[4-(morpholin-4-ylmethyl)phenyl]phenyl]methanamine
CID 10891323
4-[4-(morpholin-4-ylmethyl)phenyl]phenol
CID 39226445
4-[[4-(4-fluorophenyl)phenyl]methyl]morpholine
CID 11161574
4-(2-chloro-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl)aniline
CID 59829352
N-chloro-4-(morpholin-4-ylmethyl)pyridin-2-amine
CID 87380885
[4-[3-(morpholin-4-ylmethyl)phenyl]phenyl]methanamine
CID 39226421
2-[4-(morpholin-4-ylmethyl)phenyl]propan-2-amine
CID 82026958

Frequently Asked Questions

What is the IUPAC name of 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine?
The IUPAC name of 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine (CID 163435159) is 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine.
What is the SMILES notation for 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine?
The canonical SMILES for 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine is Nc1ccnc2cc(-c3ccc(CN4CCOCC4)cc3)sc12.
What is the InChIKey of 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine?
The InChIKey is ATWAVIOXVRMJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3OS/c19-15-5-6-20-16-11-17(23-18(15)16)14-3-1-13(2-4-14)12-21-7-9-22-10-8-21/h1-6,11H,7-10,12H2,(H2,19,20).
What are the key properties of 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine?
2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine has a molecular weight of 325.44 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-amine is sourced from PubChem (CID 163435159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).