3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone

C23H26N2O — CID 66492616

IUPAC3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone
SMILESCC1=CC(C)(C)Nc2c(C(=O)N3CCCc4ccccc43)cc(C)cc21
InChIInChI=1S/C23H26N2O/c1-15-12-18-16(2)14-23(3,4)24-21(18)19(13-15)22(26)25-11-7-9-17-8-5-6-10-20(17)25/h5-6,8,10,12-14,24H,7,9,11H2,1-4H3
InChIKeyPICVVDNXXCBOIP-UHFFFAOYSA-N
MW346.47 g/mol
LogP5.20
Rot. Bonds1

About 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone

3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone (PubChem CID 66492616) has the molecular formula C23H26N2O and a molecular weight of 346.47 g/mol. Its IUPAC name is 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone
PubChem CID66492616
Molecular FormulaC23H26N2O
Molecular Weight346.47 g/mol
Exact Mass346.20
IUPAC Name3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone
SMILESCC1=CC(C)(C)Nc2c(C(=O)N3CCCc4ccccc43)cc(C)cc21
InChIInChI=1S/C23H26N2O/c1-15-12-18-16(2)14-23(3,4)24-21(18)19(13-15)22(26)25-11-7-9-17-8-5-6-10-20(17)25/h5-6,8,10,12-14,24H,7,9,11H2,1-4H3
InChIKeyPICVVDNXXCBOIP-UHFFFAOYSA-N
XLogP5.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.47
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone with MolForge

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Related Compounds

3,4-dihydro-2H-quinolin-1-yl-(2,2,4-trimethyl-1H-quinolin-8-yl)methanone
CID 17036233
[5-bromo-2-(2,5-dimethylpyrrol-1-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 25181238
3,4-dihydro-2H-quinolin-1-yl-(3-hydroxy-2-methylphenyl)methanone
CID 82829947
3,4-dihydro-2H-quinolin-1-yl-(2-methoxyphenyl)methanone
CID 903128
3,4-dihydro-2H-quinolin-1-yl-(3,4-dimethylphenyl)methanone
CID 776290
3,4-dihydro-2H-quinolin-1-yl-(3-methylphenyl)methanone
CID 669077
3,4-dihydro-2H-quinolin-1-yl-(2,3-dimethylphenyl)methanone
CID 47097545
(5-bromo-2-methylphenyl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 65307202
(2,4-difluorophenyl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 736346
2,2,4,6-tetramethyl-1H-quinoline-8-carbohydrazide
CID 91670642
3,4-dihydro-2H-quinolin-1-yl-(2,5-dihydroxyphenyl)methanone
CID 103891274
5-(3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyrimidin-6-one
CID 110857161

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone?
The IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone (CID 66492616) is 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone?
The canonical SMILES for 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone is CC1=CC(C)(C)Nc2c(C(=O)N3CCCc4ccccc43)cc(C)cc21.
What is the InChIKey of 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone?
The InChIKey is PICVVDNXXCBOIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O/c1-15-12-18-16(2)14-23(3,4)24-21(18)19(13-15)22(26)25-11-7-9-17-8-5-6-10-20(17)25/h5-6,8,10,12-14,24H,7,9,11H2,1-4H3.
What are the key properties of 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone?
3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone has a molecular weight of 346.47 g/mol, XLogP of 5.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-quinolin-1-yl-(2,2,4,6-tetramethyl-1H-quinolin-8-yl)methanone is sourced from PubChem (CID 66492616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).