N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine

C14H13N3OS — CID 9107019

IUPACN-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine
SMILESCON(C)c1ncnc2sc(-c3ccccc3)cc12
InChIInChI=1S/C14H13N3OS/c1-17(18-2)13-11-8-12(10-6-4-3-5-7-10)19-14(11)16-9-15-13/h3-9H,1-2H3
InChIKeyDLLDZGFFZYTCAY-UHFFFAOYSA-N
MW271.35 g/mol
LogP3.36
Rot. Bonds3

About N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine

N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 9107019) has the molecular formula C14H13N3OS and a molecular weight of 271.35 g/mol. Its IUPAC name is N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine
PubChem CID9107019
Molecular FormulaC14H13N3OS
Molecular Weight271.35 g/mol
Exact Mass271.08
IUPAC NameN-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine
SMILESCON(C)c1ncnc2sc(-c3ccccc3)cc12
InChIInChI=1S/C14H13N3OS/c1-17(18-2)13-11-8-12(10-6-4-3-5-7-10)19-14(11)16-9-15-13/h3-9H,1-2H3
InChIKeyDLLDZGFFZYTCAY-UHFFFAOYSA-N
XLogP3.36
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine (CID 9107019) is N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine is CON(C)c1ncnc2sc(-c3ccccc3)cc12.
What is the InChIKey of N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is DLLDZGFFZYTCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c1-17(18-2)13-11-8-12(10-6-4-3-5-7-10)19-14(11)16-9-15-13/h3-9H,1-2H3.
What are the key properties of N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine?
N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 271.35 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 9107019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).