N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide

C23H37N3O3 — CID 136719377

IUPACN-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)NCC(=O)N/N=C\c1ccccc1O
InChIInChI=1S/C23H37N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-17-22(28)24-19-23(29)26-25-18-20-15-13-14-16-21(20)27/h13-16,18,27H,2-12,17,19H2,1H3,(H,24,28)(H,26,29)/b25-18-
InChIKeyVNRQOQIMGAZQTL-BWAHOGKJSA-N
MW403.57 g/mol
LogP4.66
Rot. Bonds16

About N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide

N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide (PubChem CID 136719377) has the molecular formula C23H37N3O3 and a molecular weight of 403.57 g/mol. Its IUPAC name is N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide.

Molecular Properties

Compound NameN-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide
PubChem CID136719377
Molecular FormulaC23H37N3O3
Molecular Weight403.57 g/mol
Exact Mass403.28
IUPAC NameN-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)NCC(=O)N/N=C\c1ccccc1O
InChIInChI=1S/C23H37N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-17-22(28)24-19-23(29)26-25-18-20-15-13-14-16-21(20)27/h13-16,18,27H,2-12,17,19H2,1H3,(H,24,28)(H,26,29)/b25-18-
InChIKeyVNRQOQIMGAZQTL-BWAHOGKJSA-N
XLogP4.66
TPSA90.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.57
LogP ≤ 54.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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'}

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Related Compounds

N-[(2-hydroxyphenyl)methylideneamino]octanamide
CID 3393777
N-[(2-hydroxyphenyl)methylideneamino]undecanamide
CID 5053269
N-[2-[(2Z)-2-[(2-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]dodecanamide
CID 6056379
N-[2-[(2E)-2-(naphthalen-1-ylmethylidene)hydrazinyl]-2-oxoethyl]tetradecanamide
CID 45054319
N-[(E)-(2-hydroxyphenyl)methylideneamino]pentanamide
CID 135509646
N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide
CID 135555032
N-[2-[2-(1H-indol-3-ylmethylidene)hydrazinyl]-2-oxoethyl]decanamide
CID 4153907
N-[2-[2-(anthracen-9-ylmethylidene)hydrazinyl]-2-oxoethyl]decanamide
CID 4142604
N-[(2-methylphenyl)methylideneamino]undecanamide
CID 4136077
N-[2-[2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]dodecanamide
CID 5101537
N-[(Z)-(2-hydroxyphenyl)methylideneamino]undec-10-enamide
CID 136802207
N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-[[2-[(2E)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]amino]acetamide
CID 177478603

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide?
The IUPAC name of N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide (CID 136719377) is N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide.
What is the SMILES notation for N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide?
The canonical SMILES for N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide is CCCCCCCCCCCCCC(=O)NCC(=O)N/N=C\c1ccccc1O.
What is the InChIKey of N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide?
The InChIKey is VNRQOQIMGAZQTL-BWAHOGKJSA-N. The full InChI is InChI=1S/C23H37N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-17-22(28)24-19-23(29)26-25-18-20-15-13-14-16-21(20)27/h13-16,18,27H,2-12,17,19H2,1H3,(H,24,28)(H,26,29)/b25-18-.
What are the key properties of N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide?
N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide has a molecular weight of 403.57 g/mol, XLogP of 4.66, 16 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide is sourced from PubChem (CID 136719377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).