2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide

C23H26N2O — CID 178169008

IUPAC2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide
SMILESCNC(=O)c1ccc2ccccc2c1.Cc1ccc2c(c1)CCN(C)C2
InChIInChI=1S/C12H11NO.C11H15N/c1-13-12(14)11-7-6-9-4-2-3-5-10(9)8-11;1-9-3-4-11-8-12(2)6-5-10(11)7-9/h2-8H,1H3,(H,13,14);3-4,7H,5-6,8H2,1-2H3
InChIKeyAJEILVHVHJXCLH-UHFFFAOYSA-N
MW346.47 g/mol
LogP4.18
Rot. Bonds1

About 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide

2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide (PubChem CID 178169008) has the molecular formula C23H26N2O and a molecular weight of 346.47 g/mol. Its IUPAC name is 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide
PubChem CID178169008
Molecular FormulaC23H26N2O
Molecular Weight346.47 g/mol
Exact Mass346.20
IUPAC Name2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide
SMILESCNC(=O)c1ccc2ccccc2c1.Cc1ccc2c(c1)CCN(C)C2
InChIInChI=1S/C12H11NO.C11H15N/c1-13-12(14)11-7-6-9-4-2-3-5-10(9)8-11;1-9-3-4-11-8-12(2)6-5-10(11)7-9/h2-8H,1H3,(H,13,14);3-4,7H,5-6,8H2,1-2H3
InChIKeyAJEILVHVHJXCLH-UHFFFAOYSA-N
XLogP4.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-1,3,4,5-tetrahydro-2-benzazepine-8-carboxamide
CID 58147184
2-methyl-N-(1-methylcyclopropyl)sulfanyl-3,4-dihydro-1H-isoquinoline-6-carboxamide
CID 142338575
N-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)naphthalene-2-sulfinamide
CID 143542459
N-(2-amino-5-methylphenyl)naphthalene-2-carboxamide
CID 115912255
N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]naphthalene-2-carboxamide
CID 31882746
2-methyl-N-[1-[(3-methylphenyl)methyl]imidazol-4-yl]-3,4-dihydro-1H-isoquinoline-6-carboxamide
CID 135209368
N-(4-bromophenyl)naphthalene-2-carboxamide;methane;N-(4-methylphenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 162012639
methyl acetate;2-methyl-3,4-dihydro-1H-isoquinoline
CID 91290502
(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-naphthalen-2-ylmethanone
CID 26083928
methanol;2-methyl-3,4-dihydro-1H-isoquinoline
CID 142001874
N-methyl-2-(6-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine
CID 142067783
N-methyl-7,8-didehydro-5,6,9,10-tetrahydrobenzo[8]annulene-3-carboxamide
CID 178014437

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide?
The IUPAC name of 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide (CID 178169008) is 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide.
What is the SMILES notation for 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide?
The canonical SMILES for 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide is CNC(=O)c1ccc2ccccc2c1.Cc1ccc2c(c1)CCN(C)C2.
What is the InChIKey of 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide?
The InChIKey is AJEILVHVHJXCLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO.C11H15N/c1-13-12(14)11-7-6-9-4-2-3-5-10(9)8-11;1-9-3-4-11-8-12(2)6-5-10(11)7-9/h2-8H,1H3,(H,13,14);3-4,7H,5-6,8H2,1-2H3.
What are the key properties of 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide?
2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide has a molecular weight of 346.47 g/mol, XLogP of 4.18, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-3,4-dihydro-1H-isoquinoline;N-methylnaphthalene-2-carboxamide is sourced from PubChem (CID 178169008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).