N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine

C15H21N3OS — CID 133352657

IUPACN-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine
SMILESCC(CNc1ccnc2ccsc12)N1CCOCC1C
InChIInChI=1S/C15H21N3OS/c1-11(18-6-7-19-10-12(18)2)9-17-13-3-5-16-14-4-8-20-15(13)14/h3-5,8,11-12H,6-7,9-10H2,1-2H3,(H,16,17)
InChIKeyLTFDDWSPQKFKDF-UHFFFAOYSA-N
MW291.42 g/mol
LogP2.82
Rot. Bonds4

About N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine

N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine (PubChem CID 133352657) has the molecular formula C15H21N3OS and a molecular weight of 291.42 g/mol. Its IUPAC name is N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine.

Molecular Properties

Compound NameN-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine
PubChem CID133352657
Molecular FormulaC15H21N3OS
Molecular Weight291.42 g/mol
Exact Mass291.14
IUPAC NameN-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine
SMILESCC(CNc1ccnc2ccsc12)N1CCOCC1C
InChIInChI=1S/C15H21N3OS/c1-11(18-6-7-19-10-12(18)2)9-17-13-3-5-16-14-4-8-20-15(13)14/h3-5,8,11-12H,6-7,9-10H2,1-2H3,(H,16,17)
InChIKeyLTFDDWSPQKFKDF-UHFFFAOYSA-N
XLogP2.82
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine?
The IUPAC name of N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine (CID 133352657) is N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine.
What is the SMILES notation for N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine?
The canonical SMILES for N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine is CC(CNc1ccnc2ccsc12)N1CCOCC1C.
What is the InChIKey of N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine?
The InChIKey is LTFDDWSPQKFKDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3OS/c1-11(18-6-7-19-10-12(18)2)9-17-13-3-5-16-14-4-8-20-15(13)14/h3-5,8,11-12H,6-7,9-10H2,1-2H3,(H,16,17).
What are the key properties of N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine?
N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine has a molecular weight of 291.42 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methylmorpholin-4-yl)propyl]thieno[3,2-b]pyridin-7-amine is sourced from PubChem (CID 133352657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).