4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide

C16H15N3O2S — CID 10064177

IUPAC4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide
SMILESCOCc1c(-c2ccccc2)sc2c(C(N)=O)cnc(N)c12
InChIInChI=1S/C16H15N3O2S/c1-21-8-11-12-14(10(16(18)20)7-19-15(12)17)22-13(11)9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H2,17,19)(H2,18,20)
InChIKeyAZTOCLYFOKONNB-UHFFFAOYSA-N
MW313.38 g/mol
LogP2.79
Rot. Bonds4

About 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide

4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide (PubChem CID 10064177) has the molecular formula C16H15N3O2S and a molecular weight of 313.38 g/mol. Its IUPAC name is 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide
PubChem CID10064177
Molecular FormulaC16H15N3O2S
Molecular Weight313.38 g/mol
Exact Mass313.09
IUPAC Name4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide
SMILESCOCc1c(-c2ccccc2)sc2c(C(N)=O)cnc(N)c12
InChIInChI=1S/C16H15N3O2S/c1-21-8-11-12-14(10(16(18)20)7-19-15(12)17)22-13(11)9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H2,17,19)(H2,18,20)
InChIKeyAZTOCLYFOKONNB-UHFFFAOYSA-N
XLogP2.79
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-Amino-N-methyl-2-phenylthieno[3,2-c]pyridine-7-carboxamide
CID 10107882
4-Amino-N-methyl-2-(p-tolyl)thieno[3,2-c]pyridine-7-carboxamide
CID 56925455
4-amino-N-methyl-2-[4-(trifluoromethoxy)phenyl]thieno[3,2-c]pyridine-7-carboxamide
CID 56925457
Ethyl 4-amino-7-carbamoylthieno[3,2-c]pyridine-2-carboxylate
CID 72945355
Methyl 4-(2-amino-5-thiophen-3-yl-3-pyridinyl)benzoate
CID 46229930
Ethyl 2-amino-5-(thiophen-3-yl)nicotinate
CID 46230146
4-Amino-2-(2-fluorophenyl)thieno[3,2-c]pyridine-7-carboxamide
CID 10266064
4-Amino-2-(4-fluorophenyl)thieno[3,2-c]pyridine-7-carboxamide
CID 11644922
4-Amino-2-(4-fluorophenyl)thieno[3,2-c]pyridine-7-carboxylic acid
CID 69757203
Methyl 4-amino-3-(4-(3-(3-fluorophenyl)ureido)phenyl)thieno[3,2-c]pyridine-7-carboxylate
CID 71224446
4-fluoro-3-(methoxymethyl)-N-(4-methyl-2-pyridinyl)-1-benzothiophene-2-carboxamide
CID 24538053
(2-Ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl 1-(5-carbamoyl-2-pyridinyl)piperidine-4-carboxylate
CID 24657768

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide?
The IUPAC name of 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide (CID 10064177) is 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide.
What is the SMILES notation for 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide?
The canonical SMILES for 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide is COCc1c(-c2ccccc2)sc2c(C(N)=O)cnc(N)c12.
What is the InChIKey of 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide?
The InChIKey is AZTOCLYFOKONNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2S/c1-21-8-11-12-14(10(16(18)20)7-19-15(12)17)22-13(11)9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H2,17,19)(H2,18,20).
What are the key properties of 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide?
4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide has a molecular weight of 313.38 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-(methoxymethyl)-2-phenylthieno[3,2-c]pyridine-7-carboxamide is sourced from PubChem (CID 10064177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).