(2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane

C18H27N — CID 143448239

IUPAC(2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane
SMILESC/C=c1/c(C)c2ccccc2n/c1=C/C.CC.CC
InChIInChI=1S/C14H15N.2C2H6/c1-4-11-10(3)12-8-6-7-9-14(12)15-13(11)5-2;2*1-2/h4-9H,1-3H3;2*1-2H3/b11-4-,13-5+;;
InChIKeyWMZNQGKNFHLQTE-ZMKDPNENSA-N
MW257.42 g/mol
LogP4.20
Rot. Bonds

About (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane

(2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane (PubChem CID 143448239) has the molecular formula C18H27N and a molecular weight of 257.42 g/mol. Its IUPAC name is (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane.

Molecular Properties

Compound Name(2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane
PubChem CID143448239
Molecular FormulaC18H27N
Molecular Weight257.42 g/mol
Exact Mass257.21
IUPAC Name(2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane
SMILESC/C=c1/c(C)c2ccccc2n/c1=C/C.CC.CC
InChIInChI=1S/C14H15N.2C2H6/c1-4-11-10(3)12-8-6-7-9-14(12)15-13(11)5-2;2*1-2/h4-9H,1-3H3;2*1-2H3/b11-4-,13-5+;;
InChIKeyWMZNQGKNFHLQTE-ZMKDPNENSA-N
XLogP4.20
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-dimethylnaphthalene;ethane
CID 90922397
(2Z,3E)-2,3-di(ethylidene)benzo[f]quinoline
CID 138606344
3,4,9-trimethylacridine
CID 58813802
ethane;11-methyl-[1]benzofuro[3,2-b]quinoline
CID 143798134
1,2-dimethylnaphthalene;ethane;propane
CID 90958253
1-(2,4-dimethylquinolin-3-yl)-N-phenylmethanimine;ethane
CID 157427941
1,1'-biphenyl;1,2-dimethylacridine
CID 175084711
4-methylquinoline-2-carbaldehyde
CID 12735795
1,2-dimethylnaphthalene;hydrobromide
CID 174429192
(2E,3Z)-2,3-di(ethylidene)-6-(10-methylanthracen-9-yl)pyridine
CID 143445076
2-methyl-4-prop-1-enylquinoline
CID 73094462
4-methyl-N-phenylquinolin-2-amine
CID 616278

Frequently Asked Questions

What is the IUPAC name of (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane?
The IUPAC name of (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane (CID 143448239) is (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane.
What is the SMILES notation for (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane?
The canonical SMILES for (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane is C/C=c1/c(C)c2ccccc2n/c1=C/C.CC.CC.
What is the InChIKey of (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane?
The InChIKey is WMZNQGKNFHLQTE-ZMKDPNENSA-N. The full InChI is InChI=1S/C14H15N.2C2H6/c1-4-11-10(3)12-8-6-7-9-14(12)15-13(11)5-2;2*1-2/h4-9H,1-3H3;2*1-2H3/b11-4-,13-5+;;.
What are the key properties of (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane?
(2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane has a molecular weight of 257.42 g/mol, XLogP of 4.20, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3Z)-2,3-di(ethylidene)-4-methylquinoline;ethane is sourced from PubChem (CID 143448239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).