N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide

C22H25N3O — CID 11314025

IUPACN,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide
SMILESCc1nc2c3c(c(C(=O)N(C)C)cn2c1C)CCC(c1ccccc1)C3
InChIInChI=1S/C22H25N3O/c1-14-15(2)25-13-20(22(26)24(3)4)18-11-10-17(12-19(18)21(25)23-14)16-8-6-5-7-9-16/h5-9,13,17H,10-12H2,1-4H3
InChIKeyCHLXKGQFNLQYNC-UHFFFAOYSA-N
MW347.46 g/mol
LogP3.93
Rot. Bonds2

About N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide

N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide (PubChem CID 11314025) has the molecular formula C22H25N3O and a molecular weight of 347.46 g/mol. Its IUPAC name is N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide.

Molecular Properties

Compound NameN,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide
PubChem CID11314025
Molecular FormulaC22H25N3O
Molecular Weight347.46 g/mol
Exact Mass347.20
IUPAC NameN,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide
SMILESCc1nc2c3c(c(C(=O)N(C)C)cn2c1C)CCC(c1ccccc1)C3
InChIInChI=1S/C22H25N3O/c1-14-15(2)25-13-20(22(26)24(3)4)18-11-10-17(12-19(18)21(25)23-14)16-8-6-5-7-9-16/h5-9,13,17H,10-12H2,1-4H3
InChIKeyCHLXKGQFNLQYNC-UHFFFAOYSA-N
XLogP3.93
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide with MolForge

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Related Compounds

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CID 65939

Frequently Asked Questions

What is the IUPAC name of N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide?
The IUPAC name of N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide (CID 11314025) is N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide.
What is the SMILES notation for N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide?
The canonical SMILES for N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide is Cc1nc2c3c(c(C(=O)N(C)C)cn2c1C)CCC(c1ccccc1)C3.
What is the InChIKey of N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide?
The InChIKey is CHLXKGQFNLQYNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O/c1-14-15(2)25-13-20(22(26)24(3)4)18-11-10-17(12-19(18)21(25)23-14)16-8-6-5-7-9-16/h5-9,13,17H,10-12H2,1-4H3.
What are the key properties of N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide?
N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide has a molecular weight of 347.46 g/mol, XLogP of 3.93, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,3-tetramethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[2,1-a]isoquinoline-6-carboxamide is sourced from PubChem (CID 11314025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).