N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

C19H20N4O — CID 71938865

IUPACN-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
SMILESCc1ccc2nc(CNC(=O)N3CCc4ccccc4C3)cn2c1
InChIInChI=1S/C19H20N4O/c1-14-6-7-18-21-17(13-23(18)11-14)10-20-19(24)22-9-8-15-4-2-3-5-16(15)12-22/h2-7,11,13H,8-10,12H2,1H3,(H,20,24)
InChIKeyZIUAIFPTFFUJIA-UHFFFAOYSA-N
MW320.40 g/mol
LogP2.91
Rot. Bonds2

About N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide (PubChem CID 71938865) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide.

Molecular Properties

Compound NameN-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
PubChem CID71938865
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC NameN-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
SMILESCc1ccc2nc(CNC(=O)N3CCc4ccccc4C3)cn2c1
InChIInChI=1S/C19H20N4O/c1-14-6-7-18-21-17(13-23(18)11-14)10-20-19(24)22-9-8-15-4-2-3-5-16(15)12-22/h2-7,11,13H,8-10,12H2,1H3,(H,20,24)
InChIKeyZIUAIFPTFFUJIA-UHFFFAOYSA-N
XLogP2.91
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide?
The IUPAC name of N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide (CID 71938865) is N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide.
What is the SMILES notation for N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide?
The canonical SMILES for N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide is Cc1ccc2nc(CNC(=O)N3CCc4ccccc4C3)cn2c1.
What is the InChIKey of N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide?
The InChIKey is ZIUAIFPTFFUJIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-14-6-7-18-21-17(13-23(18)11-14)10-20-19(24)22-9-8-15-4-2-3-5-16(15)12-22/h2-7,11,13H,8-10,12H2,1H3,(H,20,24).
What are the key properties of N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide?
N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide has a molecular weight of 320.40 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide is sourced from PubChem (CID 71938865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).