1,2,2,4,6-pentamethyl-3,4-dihydroquinoline

C14H21N — CID 14387761

IUPAC1,2,2,4,6-pentamethyl-3,4-dihydroquinoline
SMILESCc1ccc2c(c1)C(C)CC(C)(C)N2C
InChIInChI=1S/C14H21N/c1-10-6-7-13-12(8-10)11(2)9-14(3,4)15(13)5/h6-8,11H,9H2,1-5H3
InChIKeyGVPHCIOBUQZDKU-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.72
Rot. Bonds

About 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline

1,2,2,4,6-pentamethyl-3,4-dihydroquinoline (PubChem CID 14387761) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline.

Molecular Properties

Compound Name1,2,2,4,6-pentamethyl-3,4-dihydroquinoline
PubChem CID14387761
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name1,2,2,4,6-pentamethyl-3,4-dihydroquinoline
SMILESCc1ccc2c(c1)C(C)CC(C)(C)N2C
InChIInChI=1S/C14H21N/c1-10-6-7-13-12(8-10)11(2)9-14(3,4)15(13)5/h6-8,11H,9H2,1-5H3
InChIKeyGVPHCIOBUQZDKU-UHFFFAOYSA-N
XLogP3.72
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline?
The IUPAC name of 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline (CID 14387761) is 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline.
What is the SMILES notation for 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline?
The canonical SMILES for 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline is Cc1ccc2c(c1)C(C)CC(C)(C)N2C.
What is the InChIKey of 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline?
The InChIKey is GVPHCIOBUQZDKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-10-6-7-13-12(8-10)11(2)9-14(3,4)15(13)5/h6-8,11H,9H2,1-5H3.
What are the key properties of 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline?
1,2,2,4,6-pentamethyl-3,4-dihydroquinoline has a molecular weight of 203.33 g/mol, XLogP of 3.72, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,4,6-pentamethyl-3,4-dihydroquinoline is sourced from PubChem (CID 14387761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).