4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine

C18H13N5OS — CID 66760209

IUPAC4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
SMILESCn1cnc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)c1
InChIInChI=1S/C18H13N5OS/c1-23-7-14(22-9-23)12-5-21-18(19)17-11(12)4-15(24-17)13-8-25-16-6-20-3-2-10(13)16/h2-9H,1H3,(H2,19,21)
InChIKeySYLUFRPBHWHYDJ-UHFFFAOYSA-N
MW347.40 g/mol
LogP4.09
Rot. Bonds2

About 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine

4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine (PubChem CID 66760209) has the molecular formula C18H13N5OS and a molecular weight of 347.40 g/mol. Its IUPAC name is 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
PubChem CID66760209
Molecular FormulaC18H13N5OS
Molecular Weight347.40 g/mol
Exact Mass347.08
IUPAC Name4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
SMILESCn1cnc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)c1
InChIInChI=1S/C18H13N5OS/c1-23-7-14(22-9-23)12-5-21-18(19)17-11(12)4-15(24-17)13-8-25-16-6-20-3-2-10(13)16/h2-9H,1H3,(H2,19,21)
InChIKeySYLUFRPBHWHYDJ-UHFFFAOYSA-N
XLogP4.09
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The IUPAC name of 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine (CID 66760209) is 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine.
What is the SMILES notation for 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The canonical SMILES for 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine is Cn1cnc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)c1.
What is the InChIKey of 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The InChIKey is SYLUFRPBHWHYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N5OS/c1-23-7-14(22-9-23)12-5-21-18(19)17-11(12)4-15(24-17)13-8-25-16-6-20-3-2-10(13)16/h2-9H,1H3,(H2,19,21).
What are the key properties of 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine has a molecular weight of 347.40 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine is sourced from PubChem (CID 66760209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).