N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane

C115H184N10 — CID 172930889

IUPACN-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCc1cc(/C(C)=N/N=C(C)C)c2cc(CC)ccc2c1.CCc1cc(/C(C)=N/NC(C)C)c2cc(CC)ccc2c1.CCc1ccc(CC)c2cc(/C(C)=N\N=C(C)C)ccc12.CCc1ccc2c(/C(C)=N/N=C(C)C)c(CC)ccc2c1.CCc1ccc2c(/C(C)=N/NC(C)C)c(CC)ccc2c1
InChIInChI=1S/C19H26N2.C19H24N2.C19H26N2.2C19H24N2.10C2H6/c2*1-6-15-8-11-18-17(12-15)10-9-16(7-2)19(18)14(5)21-20-13(3)4;2*1-6-15-8-9-17-10-16(7-2)12-18(19(17)11-15)14(5)21-20-13(3)4;1-6-15-8-9-16(7-2)19-12-17(10-11-18(15)19)14(5)21-20-13(3)4;10*1-2/h8-13,20H,6-7H2,1-5H3;8-12H,6-7H2,1-5H3;8-13,20H,6-7H2,1-5H3;2*8-12H,6-7H2,1-5H3;10*1-2H3/b4*21-14+;21-14-;;;;;;;;;;
InChIKeyJPGAYHLYGLUHGJ-XIMJSSGNSA-N
MW1706.81 g/mol
LogP35.14
Rot. Bonds22

About N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane

N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane (PubChem CID 172930889) has the molecular formula C115H184N10 and a molecular weight of 1706.81 g/mol. Its IUPAC name is N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane.

Molecular Properties

Compound NameN-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane
PubChem CID172930889
Molecular FormulaC115H184N10
Molecular Weight1706.81 g/mol
Exact Mass1705.47
IUPAC NameN-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCc1cc(/C(C)=N/N=C(C)C)c2cc(CC)ccc2c1.CCc1cc(/C(C)=N/NC(C)C)c2cc(CC)ccc2c1.CCc1ccc(CC)c2cc(/C(C)=N\N=C(C)C)ccc12.CCc1ccc2c(/C(C)=N/N=C(C)C)c(CC)ccc2c1.CCc1ccc2c(/C(C)=N/NC(C)C)c(CC)ccc2c1
InChIInChI=1S/C19H26N2.C19H24N2.C19H26N2.2C19H24N2.10C2H6/c2*1-6-15-8-11-18-17(12-15)10-9-16(7-2)19(18)14(5)21-20-13(3)4;2*1-6-15-8-9-17-10-16(7-2)12-18(19(17)11-15)14(5)21-20-13(3)4;1-6-15-8-9-16(7-2)19-12-17(10-11-18(15)19)14(5)21-20-13(3)4;10*1-2/h8-13,20H,6-7H2,1-5H3;8-12H,6-7H2,1-5H3;8-13,20H,6-7H2,1-5H3;2*8-12H,6-7H2,1-5H3;10*1-2H3/b4*21-14+;21-14-;;;;;;;;;;
InChIKeyJPGAYHLYGLUHGJ-XIMJSSGNSA-N
XLogP35.14
TPSA122.94 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds22
Heavy Atoms125
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001706.81
LogP ≤ 535.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane with MolForge

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Related Compounds

bis(N-[(Z)-1-(3,7-diethylnaphthalen-2-yl)ethylideneamino]propan-2-amine);bis((E)-N-[(E)-1-(1,5-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine);ethane
CID 172929192
(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine
CID 160652434
(E)-N-[(E)-1-(2,4-diethylphenyl)ethylideneamino]propan-2-imine
CID 172923604
1,3,7-triethylnaphthalene
CID 71445350
2,6-diethylnaphthalene-1,8-dicarboxylic acid
CID 70141168
1-(6-ethylnaphthalen-2-yl)ethanone
CID 23046884
2,7-diethylnaphthalene-1-sulfonic acid
CID 101322406
ethane;2,3,6,7,10,11-hexaethyltriphenylene;2,6,10-triethyltriphenylene
CID 158781972
potassium 2,7-diethylnaphthalene-1-sulfonate
CID 101322405
2,5-diethylbenzoyl iodide
CID 139959906
2-(6-ethyl-1-oxoisoquinolin-2-yl)butanoic acid
CID 82063030
6-ethyl-1-propan-2-ylnaphthalene
CID 123206196

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane?
The IUPAC name of N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane (CID 172930889) is N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane.
What is the SMILES notation for N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane?
The canonical SMILES for N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCc1cc(/C(C)=N/N=C(C)C)c2cc(CC)ccc2c1.CCc1cc(/C(C)=N/NC(C)C)c2cc(CC)ccc2c1.CCc1ccc(CC)c2cc(/C(C)=N\N=C(C)C)ccc12.CCc1ccc2c(/C(C)=N/N=C(C)C)c(CC)ccc2c1.CCc1ccc2c(/C(C)=N/NC(C)C)c(CC)ccc2c1.
What is the InChIKey of N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane?
The InChIKey is JPGAYHLYGLUHGJ-XIMJSSGNSA-N. The full InChI is InChI=1S/C19H26N2.C19H24N2.C19H26N2.2C19H24N2.10C2H6/c2*1-6-15-8-11-18-17(12-15)10-9-16(7-2)19(18)14(5)21-20-13(3)4;2*1-6-15-8-9-17-10-16(7-2)12-18(19(17)11-15)14(5)21-20-13(3)4;1-6-15-8-9-16(7-2)19-12-17(10-11-18(15)19)14(5)21-20-13(3)4;10*1-2/h8-13,20H,6-7H2,1-5H3;8-12H,6-7H2,1-5H3;8-13,20H,6-7H2,1-5H3;2*8-12H,6-7H2,1-5H3;10*1-2H3/b4*21-14+;21-14-;;;;;;;;;;.
What are the key properties of N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane?
N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane has a molecular weight of 1706.81 g/mol, XLogP of 35.14, 22 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-amine;(E)-N-[(E)-1-(2,6-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(E)-N-[(E)-1-(3,7-diethylnaphthalen-1-yl)ethylideneamino]propan-2-imine;(Z)-N-[(Z)-1-(5,8-diethylnaphthalen-2-yl)ethylideneamino]propan-2-imine;ethane is sourced from PubChem (CID 172930889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).