N-(18-amino-7-hydroxyoctadecyl)acetamide

C20H42N2O2 — CID 175547048

IUPACN-(18-amino-7-hydroxyoctadecyl)acetamide
SMILESCC(=O)NCCCCCCC(O)CCCCCCCCCCCN
InChIInChI=1S/C20H42N2O2/c1-19(23)22-18-14-10-8-12-16-20(24)15-11-7-5-3-2-4-6-9-13-17-21/h20,24H,2-18,21H2,1H3,(H,22,23)
InChIKeyCNHKTAFUAHYLIG-UHFFFAOYSA-N
MW342.57 g/mol
LogP4.29
Rot. Bonds18

About N-(18-amino-7-hydroxyoctadecyl)acetamide

N-(18-amino-7-hydroxyoctadecyl)acetamide (PubChem CID 175547048) has the molecular formula C20H42N2O2 and a molecular weight of 342.57 g/mol. Its IUPAC name is N-(18-amino-7-hydroxyoctadecyl)acetamide.

Molecular Properties

Compound NameN-(18-amino-7-hydroxyoctadecyl)acetamide
PubChem CID175547048
Molecular FormulaC20H42N2O2
Molecular Weight342.57 g/mol
Exact Mass342.32
IUPAC NameN-(18-amino-7-hydroxyoctadecyl)acetamide
SMILESCC(=O)NCCCCCCC(O)CCCCCCCCCCCN
InChIInChI=1S/C20H42N2O2/c1-19(23)22-18-14-10-8-12-16-20(24)15-11-7-5-3-2-4-6-9-13-17-21/h20,24H,2-18,21H2,1H3,(H,22,23)
InChIKeyCNHKTAFUAHYLIG-UHFFFAOYSA-N
XLogP4.29
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.57
LogP ≤ 54.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-aminobutyl)acetamide;N-(5-aminopentyl)acetamide;N-(3-aminopropyl)acetamide
CID 161046106
N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide
CID 159062074
N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-[4-(3-aminopropylamino)butylamino]ethyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide
CID 159263128
N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide
CID 59687519
(2S)-2-acetamido-6-amino-N-[(2S)-6-amino-1-(4-aminobutylamino)-1-oxohexan-2-yl]hexanamide
CID 72708054
(2S)-2,6-diamino-N-[6-[[(2S)-2,6-diaminohexanoyl]amino]hexyl]hexanamide
CID 100984594
2,6-diamino-N-[10-(2,6-diaminohexanoylamino)decyl]hexanamide
CID 4011235
N-[4-(3-aminopropylamino)butyl]acetamide;hydron;dichloride
CID 74764694
[(2R)-2-hydroxypropanoyl] (2R)-2-[[(2R)-2-[[(2S)-6-acetamido-2-(6-aminohexanoylamino)hexanoyl]amino]propanoyl]amino]propanoate
CID 101082128
N-(3-aminopropyl)-3-hydroxytetradecanamide
CID 139771508
N-(7-aminoheptyl)-2-methylpropanamide
CID 89281092
N-[5-(methylamino)-6-oxoheptyl]acetamide
CID 72531046

Frequently Asked Questions

What is the IUPAC name of N-(18-amino-7-hydroxyoctadecyl)acetamide?
The IUPAC name of N-(18-amino-7-hydroxyoctadecyl)acetamide (CID 175547048) is N-(18-amino-7-hydroxyoctadecyl)acetamide.
What is the SMILES notation for N-(18-amino-7-hydroxyoctadecyl)acetamide?
The canonical SMILES for N-(18-amino-7-hydroxyoctadecyl)acetamide is CC(=O)NCCCCCCC(O)CCCCCCCCCCCN.
What is the InChIKey of N-(18-amino-7-hydroxyoctadecyl)acetamide?
The InChIKey is CNHKTAFUAHYLIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42N2O2/c1-19(23)22-18-14-10-8-12-16-20(24)15-11-7-5-3-2-4-6-9-13-17-21/h20,24H,2-18,21H2,1H3,(H,22,23).
What are the key properties of N-(18-amino-7-hydroxyoctadecyl)acetamide?
N-(18-amino-7-hydroxyoctadecyl)acetamide has a molecular weight of 342.57 g/mol, XLogP of 4.29, 18 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(18-amino-7-hydroxyoctadecyl)acetamide is sourced from PubChem (CID 175547048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).