N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide

C24H30N4O4 — CID 135555032

IUPACN,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide
SMILESO=C(CCCCCCCCC(=O)N/N=C/c1ccccc1O)N/N=C/c1ccccc1O
InChIInChI=1S/C24H30N4O4/c29-21-13-9-7-11-19(21)17-25-27-23(31)15-5-3-1-2-4-6-16-24(32)28-26-18-20-12-8-10-14-22(20)30/h7-14,17-18,29-30H,1-6,15-16H2,(H,27,31)(H,28,32)/b25-17+,26-18+
InChIKeyFAGCLRMEOSNCKD-RPCRKUJJSA-N
MW438.53 g/mol
LogP3.82
Rot. Bonds13

About N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide

N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide (PubChem CID 135555032) has the molecular formula C24H30N4O4 and a molecular weight of 438.53 g/mol. Its IUPAC name is N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide.

Molecular Properties

Compound NameN,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide
PubChem CID135555032
Molecular FormulaC24H30N4O4
Molecular Weight438.53 g/mol
Exact Mass438.23
IUPAC NameN,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide
SMILESO=C(CCCCCCCCC(=O)N/N=C/c1ccccc1O)N/N=C/c1ccccc1O
InChIInChI=1S/C24H30N4O4/c29-21-13-9-7-11-19(21)17-25-27-23(31)15-5-3-1-2-4-6-16-24(32)28-26-18-20-12-8-10-14-22(20)30/h7-14,17-18,29-30H,1-6,15-16H2,(H,27,31)(H,28,32)/b25-17+,26-18+
InChIKeyFAGCLRMEOSNCKD-RPCRKUJJSA-N
XLogP3.82
TPSA123.38 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.53
LogP ≤ 53.82
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-hydroxyphenyl)methylideneamino]octanamide
CID 3393777
N-[(2-hydroxyphenyl)methylideneamino]undecanamide
CID 5053269
N-[(Z)-(2-hydroxyphenyl)methylideneamino]undec-10-enamide
CID 136802207
N-[(E)-(2-hydroxyphenyl)methylideneamino]pentanamide
CID 135509646
4-anilino-N-[(Z)-(2-hydroxyphenyl)methylideneamino]butanamide
CID 136794094
N,N'-bis[(2-fluorophenyl)methylideneamino]heptanediamide
CID 4059659
N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide
CID 136719377
N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-[[2-[(2E)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]amino]acetamide
CID 177478603
3-[(2E)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-oxopropanoate
CID 135683195
N,N'-bis[(2,4-dihydroxyphenyl)methylideneamino]dodecanediamide
CID 3615111
N,N'-bis[(2,4-dihydroxyphenyl)methylideneamino]octanediamide
CID 4632012
N-(4-bromophenyl)-N'-[(2-hydroxyphenyl)methylideneamino]butanediamide
CID 4530785

Frequently Asked Questions

What is the IUPAC name of N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide?
The IUPAC name of N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide (CID 135555032) is N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide.
What is the SMILES notation for N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide?
The canonical SMILES for N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide is O=C(CCCCCCCCC(=O)N/N=C/c1ccccc1O)N/N=C/c1ccccc1O.
What is the InChIKey of N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide?
The InChIKey is FAGCLRMEOSNCKD-RPCRKUJJSA-N. The full InChI is InChI=1S/C24H30N4O4/c29-21-13-9-7-11-19(21)17-25-27-23(31)15-5-3-1-2-4-6-16-24(32)28-26-18-20-12-8-10-14-22(20)30/h7-14,17-18,29-30H,1-6,15-16H2,(H,27,31)(H,28,32)/b25-17+,26-18+.
What are the key properties of N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide?
N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide has a molecular weight of 438.53 g/mol, XLogP of 3.82, 13 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide is sourced from PubChem (CID 135555032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).