(6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline

C18H27N — CID 171819581

IUPAC(6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline
SMILESCc1c/c(=C/CC(C)C)cc2c1=NC(C)(C)CC2C
InChIInChI=1S/C18H27N/c1-12(2)7-8-15-9-13(3)17-16(10-15)14(4)11-18(5,6)19-17/h8-10,12,14H,7,11H2,1-6H3/b15-8-
InChIKeyKDNWVGHNOVLKHQ-NVNXTCNLSA-N
MW257.42 g/mol
LogP3.73
Rot. Bonds2

About (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline

(6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline (PubChem CID 171819581) has the molecular formula C18H27N and a molecular weight of 257.42 g/mol. Its IUPAC name is (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline.

Molecular Properties

Compound Name(6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline
PubChem CID171819581
Molecular FormulaC18H27N
Molecular Weight257.42 g/mol
Exact Mass257.21
IUPAC Name(6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline
SMILESCc1c/c(=C/CC(C)C)cc2c1=NC(C)(C)CC2C
InChIInChI=1S/C18H27N/c1-12(2)7-8-15-9-13(3)17-16(10-15)14(4)11-18(5,6)19-17/h8-10,12,14H,7,11H2,1-6H3/b15-8-
InChIKeyKDNWVGHNOVLKHQ-NVNXTCNLSA-N
XLogP3.73
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline?
The IUPAC name of (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline (CID 171819581) is (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline.
What is the SMILES notation for (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline?
The canonical SMILES for (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline is Cc1c/c(=C/CC(C)C)cc2c1=NC(C)(C)CC2C.
What is the InChIKey of (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline?
The InChIKey is KDNWVGHNOVLKHQ-NVNXTCNLSA-N. The full InChI is InChI=1S/C18H27N/c1-12(2)7-8-15-9-13(3)17-16(10-15)14(4)11-18(5,6)19-17/h8-10,12,14H,7,11H2,1-6H3/b15-8-.
What are the key properties of (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline?
(6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline has a molecular weight of 257.42 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-2,2,4,8-tetramethyl-6-(3-methylbutylidene)-3,4-dihydroquinoline is sourced from PubChem (CID 171819581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).