N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide

C18H26Cl2N2O — CID 4154549

IUPACN-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide
SMILESCCCCCCCCC(=O)NN=C(CC)c1ccc(Cl)cc1Cl
InChIInChI=1S/C18H26Cl2N2O/c1-3-5-6-7-8-9-10-18(23)22-21-17(4-2)15-12-11-14(19)13-16(15)20/h11-13H,3-10H2,1-2H3,(H,22,23)
InChIKeyBCFOYOXIYGMXAK-UHFFFAOYSA-N
MW357.33 g/mol
LogP5.97
Rot. Bonds10

About N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide

N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide (PubChem CID 4154549) has the molecular formula C18H26Cl2N2O and a molecular weight of 357.33 g/mol. Its IUPAC name is N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide.

Molecular Properties

Compound NameN-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide
PubChem CID4154549
Molecular FormulaC18H26Cl2N2O
Molecular Weight357.33 g/mol
Exact Mass356.14
IUPAC NameN-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide
SMILESCCCCCCCCC(=O)NN=C(CC)c1ccc(Cl)cc1Cl
InChIInChI=1S/C18H26Cl2N2O/c1-3-5-6-7-8-9-10-18(23)22-21-17(4-2)15-12-11-14(19)13-16(15)20/h11-13H,3-10H2,1-2H3,(H,22,23)
InChIKeyBCFOYOXIYGMXAK-UHFFFAOYSA-N
XLogP5.97
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.33
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(E)-1-(2,4-dichlorophenyl)propylideneamino]nonanamide
CID 6023036
N-[(E)-1-(3-chlorophenyl)propylideneamino]nonanamide
CID 6063002
N-[(E)-1-(4-chlorophenyl)propylideneamino]hexanamide
CID 6029977
N-[1-(2,4-dichlorophenyl)pentylideneamino]acetamide
CID 88673856
N-[(E)-1-(2-hydroxyphenyl)propylideneamino]dodecanamide
CID 135533779
N'-[1-(2,4-dichlorophenyl)propylideneamino]oxamide
CID 4181307
1-(2,4-dichlorophenyl)decane-1,3-dione
CID 43321487
N-[(Z)-1-(2,4-dichlorophenyl)propylideneamino]cyclopropanecarboxamide
CID 6300945
N-[1-(2,4-dichlorophenyl)propylideneamino]-2-naphthalen-1-ylacetamide
CID 4133962
4-(2,4-dichlorophenoxy)-N-[1-(2-hydroxyphenyl)propylideneamino]butanamide
CID 4163359
1-(2,4-dichlorophenyl)hexan-1-one
CID 57230005
4-tert-butyl-N-[1-(2,4-dichlorophenyl)propylideneamino]benzamide
CID 3681131

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide?
The IUPAC name of N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide (CID 4154549) is N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide.
What is the SMILES notation for N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide?
The canonical SMILES for N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide is CCCCCCCCC(=O)NN=C(CC)c1ccc(Cl)cc1Cl.
What is the InChIKey of N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide?
The InChIKey is BCFOYOXIYGMXAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26Cl2N2O/c1-3-5-6-7-8-9-10-18(23)22-21-17(4-2)15-12-11-14(19)13-16(15)20/h11-13H,3-10H2,1-2H3,(H,22,23).
What are the key properties of N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide?
N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide has a molecular weight of 357.33 g/mol, XLogP of 5.97, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dichlorophenyl)propylideneamino]nonanamide is sourced from PubChem (CID 4154549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).