(2R)-2-(4-nitrophenoxy)tetradecanehydrazide

C20H33N3O4 — CID 95240315

IUPAC(2R)-2-(4-nitrophenoxy)tetradecanehydrazide
SMILESCCCCCCCCCCCC[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NN
InChIInChI=1S/C20H33N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-19(20(24)22-21)27-18-15-13-17(14-16-18)23(25)26/h13-16,19H,2-12,21H2,1H3,(H,22,24)/t19-/m1/s1
InChIKeyKIOIRKCJGMENQO-LJQANCHMSA-N
MW379.50 g/mol
LogP4.64
Rot. Bonds15

About (2R)-2-(4-nitrophenoxy)tetradecanehydrazide

(2R)-2-(4-nitrophenoxy)tetradecanehydrazide (PubChem CID 95240315) has the molecular formula C20H33N3O4 and a molecular weight of 379.50 g/mol. Its IUPAC name is (2R)-2-(4-nitrophenoxy)tetradecanehydrazide.

Molecular Properties

Compound Name(2R)-2-(4-nitrophenoxy)tetradecanehydrazide
PubChem CID95240315
Molecular FormulaC20H33N3O4
Molecular Weight379.50 g/mol
Exact Mass379.25
IUPAC Name(2R)-2-(4-nitrophenoxy)tetradecanehydrazide
SMILESCCCCCCCCCCCC[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NN
InChIInChI=1S/C20H33N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-19(20(24)22-21)27-18-15-13-17(14-16-18)23(25)26/h13-16,19H,2-12,21H2,1H3,(H,22,24)/t19-/m1/s1
InChIKeyKIOIRKCJGMENQO-LJQANCHMSA-N
XLogP4.64
TPSA107.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (2R)-2-(4-nitrophenoxy)tetradecanehydrazide 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

methyl 2-(4-nitrophenoxy)dodecanoate
CID 67897730
(4-nitrophenyl) 2-propyloctanoate
CID 151106755
ethyl (2S)-2-(4-nitrophenoxy)butanoate
CID 95358569
ethyl 2-(3-nitrophenoxy)tetradecanoate
CID 14122414
henicosan-11-yl (4-nitrophenyl) carbonate
CID 177314956
(4-nitrophenyl) tetratriacontan-17-yl carbonate
CID 58391317
(2S)-2-(4-nitrophenoxy)butanoate
CID 7858570
(2R)-2-(4-nitrophenoxy)butanoic acid
CID 7019234
N-(4-hexoxyphenyl)-2-(4-nitrophenoxy)propanamide
CID 4951338
ethyl (2R)-2-(4-nitrophenyl)sulfonyloxyheptanoate
CID 15720928
1-(1-chloropentoxy)-4-nitrobenzene
CID 175239946
decyl (4-nitrophenyl) carbonate
CID 139808256

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-nitrophenoxy)tetradecanehydrazide?
The IUPAC name of (2R)-2-(4-nitrophenoxy)tetradecanehydrazide (CID 95240315) is (2R)-2-(4-nitrophenoxy)tetradecanehydrazide.
What is the SMILES notation for (2R)-2-(4-nitrophenoxy)tetradecanehydrazide?
The canonical SMILES for (2R)-2-(4-nitrophenoxy)tetradecanehydrazide is CCCCCCCCCCCC[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NN.
What is the InChIKey of (2R)-2-(4-nitrophenoxy)tetradecanehydrazide?
The InChIKey is KIOIRKCJGMENQO-LJQANCHMSA-N. The full InChI is InChI=1S/C20H33N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-19(20(24)22-21)27-18-15-13-17(14-16-18)23(25)26/h13-16,19H,2-12,21H2,1H3,(H,22,24)/t19-/m1/s1.
What are the key properties of (2R)-2-(4-nitrophenoxy)tetradecanehydrazide?
(2R)-2-(4-nitrophenoxy)tetradecanehydrazide has a molecular weight of 379.50 g/mol, XLogP of 4.64, 15 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-nitrophenoxy)tetradecanehydrazide is sourced from PubChem (CID 95240315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).