1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline

C20H23N — CID 146207875

IUPAC1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline
SMILESC=C1CCc2cc(-c3ccc(C(C)C)cc3)ccc2N1C
InChIInChI=1S/C20H23N/c1-14(2)16-7-9-17(10-8-16)18-11-12-20-19(13-18)6-5-15(3)21(20)4/h7-14H,3,5-6H2,1-2,4H3
InChIKeyMDHSIKRYWVKRKM-UHFFFAOYSA-N
MW277.41 g/mol
LogP5.37
Rot. Bonds2

About 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline

1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline (PubChem CID 146207875) has the molecular formula C20H23N and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline.

Molecular Properties

Compound Name1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline
PubChem CID146207875
Molecular FormulaC20H23N
Molecular Weight277.41 g/mol
Exact Mass277.18
IUPAC Name1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline
SMILESC=C1CCc2cc(-c3ccc(C(C)C)cc3)ccc2N1C
InChIInChI=1S/C20H23N/c1-14(2)16-7-9-17(10-8-16)18-11-12-20-19(13-18)6-5-15(3)21(20)4/h7-14H,3,5-6H2,1-2,4H3
InChIKeyMDHSIKRYWVKRKM-UHFFFAOYSA-N
XLogP5.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500277.41
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline?
The IUPAC name of 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline (CID 146207875) is 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline.
What is the SMILES notation for 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline?
The canonical SMILES for 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline is C=C1CCc2cc(-c3ccc(C(C)C)cc3)ccc2N1C.
What is the InChIKey of 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline?
The InChIKey is MDHSIKRYWVKRKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N/c1-14(2)16-7-9-17(10-8-16)18-11-12-20-19(13-18)6-5-15(3)21(20)4/h7-14H,3,5-6H2,1-2,4H3.
What are the key properties of 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline?
1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline has a molecular weight of 277.41 g/mol, XLogP of 5.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-methylidene-6-(4-propan-2-ylphenyl)-3,4-dihydroquinoline is sourced from PubChem (CID 146207875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).