N,N-di(heptadecyl)hydroxylamine

C34H71NO — CID 71426964

IUPACN,N-di(heptadecyl)hydroxylamine
SMILESCCCCCCCCCCCCCCCCCN(O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C34H71NO/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(36)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36H,3-34H2,1-2H3
InChIKeyOEJXUHHCCCTBTQ-UHFFFAOYSA-N
MW509.95 g/mol
LogP12.42
Rot. Bonds32

About N,N-di(heptadecyl)hydroxylamine

N,N-di(heptadecyl)hydroxylamine (PubChem CID 71426964) has the molecular formula C34H71NO and a molecular weight of 509.95 g/mol. Its IUPAC name is N,N-di(heptadecyl)hydroxylamine.

Molecular Properties

Compound NameN,N-di(heptadecyl)hydroxylamine
PubChem CID71426964
Molecular FormulaC34H71NO
Molecular Weight509.95 g/mol
Exact Mass509.55
IUPAC NameN,N-di(heptadecyl)hydroxylamine
SMILESCCCCCCCCCCCCCCCCCN(O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C34H71NO/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(36)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36H,3-34H2,1-2H3
InChIKeyOEJXUHHCCCTBTQ-UHFFFAOYSA-N
XLogP12.42
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds32
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500509.95
LogP ≤ 512.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-decyl-N-dodecylhydroxylamine
CID 151707485
butane;N,N-dioctylhydroxylamine
CID 166773376
N,N-dihexylhydroxylamine;propane
CID 166773382
N-[3-(dimethylamino)propyl]-N-octadecylhydroxylamine
CID 129186386
N-methyl-N-nonadecylhydroxylamine
CID 87390757
N,N-bis[(9Z,12Z)-octadeca-9,12-dienyl]hydroxylamine
CID 134498270
N-[3-[4-(3-aminopropylamino)butylamino]propyl]-N-tetradecylhydroxylamine
CID 174830019
N-heptadecyl-N-heptylheptadecan-1-amine
CID 139722683
N,N,N',N'-tetra(undecyl)pentane-1,5-diamine
CID 152635971
N-docosyl-N-icosyldocosan-1-amine
CID 23464225
N,N-dipentylpentadecan-1-amine
CID 139722952
N,N-didodecyltridecan-1-amine
CID 87212898

Frequently Asked Questions

What is the IUPAC name of N,N-di(heptadecyl)hydroxylamine?
The IUPAC name of N,N-di(heptadecyl)hydroxylamine (CID 71426964) is N,N-di(heptadecyl)hydroxylamine.
What is the SMILES notation for N,N-di(heptadecyl)hydroxylamine?
The canonical SMILES for N,N-di(heptadecyl)hydroxylamine is CCCCCCCCCCCCCCCCCN(O)CCCCCCCCCCCCCCCCC.
What is the InChIKey of N,N-di(heptadecyl)hydroxylamine?
The InChIKey is OEJXUHHCCCTBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H71NO/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(36)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36H,3-34H2,1-2H3.
What are the key properties of N,N-di(heptadecyl)hydroxylamine?
N,N-di(heptadecyl)hydroxylamine has a molecular weight of 509.95 g/mol, XLogP of 12.42, 32 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(heptadecyl)hydroxylamine is sourced from PubChem (CID 71426964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).