N'-dodecyl-2-hydroxyethanimidamide

C14H30N2O — CID 90353251

IUPACN'-dodecyl-2-hydroxyethanimidamide
SMILESCCCCCCCCCCCC/N=C(/N)CO
InChIInChI=1S/C14H30N2O/c1-2-3-4-5-6-7-8-9-10-11-12-16-14(15)13-17/h17H,2-13H2,1H3,(H2,15,16)
InChIKeyPAABVOLIPGXENL-UHFFFAOYSA-N
MW242.41 g/mol
LogP3.26
Rot. Bonds12

About N'-dodecyl-2-hydroxyethanimidamide

N'-dodecyl-2-hydroxyethanimidamide (PubChem CID 90353251) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N'-dodecyl-2-hydroxyethanimidamide.

Molecular Properties

Compound NameN'-dodecyl-2-hydroxyethanimidamide
PubChem CID90353251
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN'-dodecyl-2-hydroxyethanimidamide
SMILESCCCCCCCCCCCC/N=C(/N)CO
InChIInChI=1S/C14H30N2O/c1-2-3-4-5-6-7-8-9-10-11-12-16-14(15)13-17/h17H,2-13H2,1H3,(H2,15,16)
InChIKeyPAABVOLIPGXENL-UHFFFAOYSA-N
XLogP3.26
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 53.26
H-Bond Donors ≤ 52
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': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-dodecyl-2-hydroxyethanimidamide?
The IUPAC name of N'-dodecyl-2-hydroxyethanimidamide (CID 90353251) is N'-dodecyl-2-hydroxyethanimidamide.
What is the SMILES notation for N'-dodecyl-2-hydroxyethanimidamide?
The canonical SMILES for N'-dodecyl-2-hydroxyethanimidamide is CCCCCCCCCCCC/N=C(/N)CO.
What is the InChIKey of N'-dodecyl-2-hydroxyethanimidamide?
The InChIKey is PAABVOLIPGXENL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-2-3-4-5-6-7-8-9-10-11-12-16-14(15)13-17/h17H,2-13H2,1H3,(H2,15,16).
What are the key properties of N'-dodecyl-2-hydroxyethanimidamide?
N'-dodecyl-2-hydroxyethanimidamide has a molecular weight of 242.41 g/mol, XLogP of 3.26, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-dodecyl-2-hydroxyethanimidamide is sourced from PubChem (CID 90353251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).