N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide

C20H24N2O — CID 24901536

IUPACN,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide
SMILESCc1ccc2c(c1C)CN(C(=O)N(C)C)CC2c1ccccc1
InChIInChI=1S/C20H24N2O/c1-14-10-11-17-18(15(14)2)12-22(20(23)21(3)4)13-19(17)16-8-6-5-7-9-16/h5-11,19H,12-13H2,1-4H3
InChIKeyWRHXBNXMMHHCPY-UHFFFAOYSA-N
MW308.43 g/mol
LogP3.93
Rot. Bonds1

About N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide

N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide (PubChem CID 24901536) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide.

Molecular Properties

Compound NameN,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide
PubChem CID24901536
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC NameN,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide
SMILESCc1ccc2c(c1C)CN(C(=O)N(C)C)CC2c1ccccc1
InChIInChI=1S/C20H24N2O/c1-14-10-11-17-18(15(14)2)12-22(20(23)21(3)4)13-19(17)16-8-6-5-7-9-16/h5-11,19H,12-13H2,1-4H3
InChIKeyWRHXBNXMMHHCPY-UHFFFAOYSA-N
XLogP3.93
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide?
The IUPAC name of N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide (CID 24901536) is N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide.
What is the SMILES notation for N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide?
The canonical SMILES for N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide is Cc1ccc2c(c1C)CN(C(=O)N(C)C)CC2c1ccccc1.
What is the InChIKey of N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide?
The InChIKey is WRHXBNXMMHHCPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-14-10-11-17-18(15(14)2)12-22(20(23)21(3)4)13-19(17)16-8-6-5-7-9-16/h5-11,19H,12-13H2,1-4H3.
What are the key properties of N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide?
N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide has a molecular weight of 308.43 g/mol, XLogP of 3.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,7,8-tetramethyl-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide is sourced from PubChem (CID 24901536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).