N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine

C10H13N3OS — CID 62349476

IUPACN-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine
SMILESCNCC(C)Oc1ncnc2sccc12
InChIInChI=1S/C10H13N3OS/c1-7(5-11-2)14-9-8-3-4-15-10(8)13-6-12-9/h3-4,6-7,11H,5H2,1-2H3
InChIKeyZGKZSOJNHKJQIA-UHFFFAOYSA-N
MW223.30 g/mol
LogP1.68
Rot. Bonds4

About N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine

N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine (PubChem CID 62349476) has the molecular formula C10H13N3OS and a molecular weight of 223.30 g/mol. Its IUPAC name is N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine.

Molecular Properties

Compound NameN-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine
PubChem CID62349476
Molecular FormulaC10H13N3OS
Molecular Weight223.30 g/mol
Exact Mass223.08
IUPAC NameN-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine
SMILESCNCC(C)Oc1ncnc2sccc12
InChIInChI=1S/C10H13N3OS/c1-7(5-11-2)14-9-8-3-4-15-10(8)13-6-12-9/h3-4,6-7,11H,5H2,1-2H3
InChIKeyZGKZSOJNHKJQIA-UHFFFAOYSA-N
XLogP1.68
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine?
The IUPAC name of N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine (CID 62349476) is N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine.
What is the SMILES notation for N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine?
The canonical SMILES for N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine is CNCC(C)Oc1ncnc2sccc12.
What is the InChIKey of N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine?
The InChIKey is ZGKZSOJNHKJQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS/c1-7(5-11-2)14-9-8-3-4-15-10(8)13-6-12-9/h3-4,6-7,11H,5H2,1-2H3.
What are the key properties of N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine?
N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine has a molecular weight of 223.30 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-thieno[2,3-d]pyrimidin-4-yloxypropan-1-amine is sourced from PubChem (CID 62349476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).