4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine

C16H18N6O — CID 164615885

IUPAC4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
SMILESc1nc2c([nH]1)CCNC2c1ccc(C2NCCc3[nH]cnc32)o1
InChIInChI=1S/C16H18N6O/c1-2-12(16-14-10(4-6-18-16)20-8-22-14)23-11(1)15-13-9(3-5-17-15)19-7-21-13/h1-2,7-8,15-18H,3-6H2,(H,19,21)(H,20,22)
InChIKeyWRQSZYHMYKKANK-UHFFFAOYSA-N
MW310.36 g/mol
LogP1.20
Rot. Bonds2

About 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine

4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine (PubChem CID 164615885) has the molecular formula C16H18N6O and a molecular weight of 310.36 g/mol. Its IUPAC name is 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
PubChem CID164615885
Molecular FormulaC16H18N6O
Molecular Weight310.36 g/mol
Exact Mass310.15
IUPAC Name4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
SMILESc1nc2c([nH]1)CCNC2c1ccc(C2NCCc3[nH]cnc32)o1
InChIInChI=1S/C16H18N6O/c1-2-12(16-14-10(4-6-18-16)20-8-22-14)23-11(1)15-13-9(3-5-17-15)19-7-21-13/h1-2,7-8,15-18H,3-6H2,(H,19,21)(H,20,22)
InChIKeyWRQSZYHMYKKANK-UHFFFAOYSA-N
XLogP1.20
TPSA94.56 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 51.20
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine?
The IUPAC name of 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine (CID 164615885) is 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine?
The canonical SMILES for 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine is c1nc2c([nH]1)CCNC2c1ccc(C2NCCc3[nH]cnc32)o1.
What is the InChIKey of 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine?
The InChIKey is WRQSZYHMYKKANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6O/c1-2-12(16-14-10(4-6-18-16)20-8-22-14)23-11(1)15-13-9(3-5-17-15)19-7-21-13/h1-2,7-8,15-18H,3-6H2,(H,19,21)(H,20,22).
What are the key properties of 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine?
4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine has a molecular weight of 310.36 g/mol, XLogP of 1.20, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-4-yl)furan-2-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 164615885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).