N-(6-aminohexyl)dodecanamide

C18H38N2O — CID 13030555

IUPACN-(6-aminohexyl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NCCCCCCN
InChIInChI=1S/C18H38N2O/c1-2-3-4-5-6-7-8-9-12-15-18(21)20-17-14-11-10-13-16-19/h2-17,19H2,1H3,(H,20,21)
InChIKeyOCQBSGRSYKOGCE-UHFFFAOYSA-N
MW298.51 g/mol
LogP4.54
Rot. Bonds16

About N-(6-aminohexyl)dodecanamide

N-(6-aminohexyl)dodecanamide (PubChem CID 13030555) has the molecular formula C18H38N2O and a molecular weight of 298.51 g/mol. Its IUPAC name is N-(6-aminohexyl)dodecanamide.

Molecular Properties

Compound NameN-(6-aminohexyl)dodecanamide
PubChem CID13030555
Molecular FormulaC18H38N2O
Molecular Weight298.51 g/mol
Exact Mass298.30
IUPAC NameN-(6-aminohexyl)dodecanamide
SMILESCCCCCCCCCCCC(=O)NCCCCCCN
InChIInChI=1S/C18H38N2O/c1-2-3-4-5-6-7-8-9-12-15-18(21)20-17-14-11-10-13-16-19/h2-17,19H2,1H3,(H,20,21)
InChIKeyOCQBSGRSYKOGCE-UHFFFAOYSA-N
XLogP4.54
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.51
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-aminobutyl)tetracosanamide
CID 171117181
N-(9-aminononyl)nonanamide
CID 154091260
5-amino-N-dodecylpentanamide;hydrochloride
CID 135363918
6-amino-N-pentylhexanamide;hydrochloride
CID 51041459
6-amino-N-butylhexanamide
CID 14914743
7-amino-N-butylheptanamide
CID 24689519
(Z)-N-(4-aminobutyl)pentadec-9-enamide
CID 171117158
N-[8-(dodecanoylamino)octyl]dodecanamide
CID 3273664
N-[7-(dodecanoylamino)heptyl]dodecanamide
CID 4580774
N-[6-(pentadecanoylamino)hexyl]pentadecanamide
CID 102117556
N-dodecylhexanamide
CID 3362981
N,N'-dihexadecyldecanediamide
CID 17080069

Frequently Asked Questions

What is the IUPAC name of N-(6-aminohexyl)dodecanamide?
The IUPAC name of N-(6-aminohexyl)dodecanamide (CID 13030555) is N-(6-aminohexyl)dodecanamide.
What is the SMILES notation for N-(6-aminohexyl)dodecanamide?
The canonical SMILES for N-(6-aminohexyl)dodecanamide is CCCCCCCCCCCC(=O)NCCCCCCN.
What is the InChIKey of N-(6-aminohexyl)dodecanamide?
The InChIKey is OCQBSGRSYKOGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N2O/c1-2-3-4-5-6-7-8-9-12-15-18(21)20-17-14-11-10-13-16-19/h2-17,19H2,1H3,(H,20,21).
What are the key properties of N-(6-aminohexyl)dodecanamide?
N-(6-aminohexyl)dodecanamide has a molecular weight of 298.51 g/mol, XLogP of 4.54, 16 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-aminohexyl)dodecanamide is sourced from PubChem (CID 13030555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).