4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline

C15H14N4 — CID 65263152

IUPAC4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline
SMILESc1ccc2c(c1)CNCC2c1nc2ccncc2[nH]1
InChIInChI=1S/C15H14N4/c1-2-4-11-10(3-1)7-17-8-12(11)15-18-13-5-6-16-9-14(13)19-15/h1-6,9,12,17H,7-8H2,(H,18,19)
InChIKeyOGDRBRHEKVFYKF-UHFFFAOYSA-N
MW250.31 g/mol
LogP2.19
Rot. Bonds1

About 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline

4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline (PubChem CID 65263152) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline.

Molecular Properties

Compound Name4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline
PubChem CID65263152
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC Name4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline
SMILESc1ccc2c(c1)CNCC2c1nc2ccncc2[nH]1
InChIInChI=1S/C15H14N4/c1-2-4-11-10(3-1)7-17-8-12(11)15-18-13-5-6-16-9-14(13)19-15/h1-6,9,12,17H,7-8H2,(H,18,19)
InChIKeyOGDRBRHEKVFYKF-UHFFFAOYSA-N
XLogP2.19
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline?
The IUPAC name of 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline (CID 65263152) is 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline.
What is the SMILES notation for 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline?
The canonical SMILES for 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline is c1ccc2c(c1)CNCC2c1nc2ccncc2[nH]1.
What is the InChIKey of 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline?
The InChIKey is OGDRBRHEKVFYKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-2-4-11-10(3-1)7-17-8-12(11)15-18-13-5-6-16-9-14(13)19-15/h1-6,9,12,17H,7-8H2,(H,18,19).
What are the key properties of 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline?
4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline has a molecular weight of 250.31 g/mol, XLogP of 2.19, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3H-imidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline is sourced from PubChem (CID 65263152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).