N-(6-aminohexyl)-6-hydroxyhexanamide

C12H26N2O2 — CID 3024494

IUPACN-(6-aminohexyl)-6-hydroxyhexanamide
SMILESNCCCCCCNC(=O)CCCCCO
InChIInChI=1S/C12H26N2O2/c13-9-5-1-2-6-10-14-12(16)8-4-3-7-11-15/h15H,1-11,13H2,(H,14,16)
InChIKeyPPTSELWQYYWEQG-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.17
Rot. Bonds11

About N-(6-aminohexyl)-6-hydroxyhexanamide

N-(6-aminohexyl)-6-hydroxyhexanamide (PubChem CID 3024494) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-(6-aminohexyl)-6-hydroxyhexanamide.

Molecular Properties

Compound NameN-(6-aminohexyl)-6-hydroxyhexanamide
PubChem CID3024494
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-(6-aminohexyl)-6-hydroxyhexanamide
SMILESNCCCCCCNC(=O)CCCCCO
InChIInChI=1S/C12H26N2O2/c13-9-5-1-2-6-10-14-12(16)8-4-3-7-11-15/h15H,1-11,13H2,(H,14,16)
InChIKeyPPTSELWQYYWEQG-UHFFFAOYSA-N
XLogP1.17
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.17
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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Frequently Asked Questions

What is the IUPAC name of N-(6-aminohexyl)-6-hydroxyhexanamide?
The IUPAC name of N-(6-aminohexyl)-6-hydroxyhexanamide (CID 3024494) is N-(6-aminohexyl)-6-hydroxyhexanamide.
What is the SMILES notation for N-(6-aminohexyl)-6-hydroxyhexanamide?
The canonical SMILES for N-(6-aminohexyl)-6-hydroxyhexanamide is NCCCCCCNC(=O)CCCCCO.
What is the InChIKey of N-(6-aminohexyl)-6-hydroxyhexanamide?
The InChIKey is PPTSELWQYYWEQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c13-9-5-1-2-6-10-14-12(16)8-4-3-7-11-15/h15H,1-11,13H2,(H,14,16).
What are the key properties of N-(6-aminohexyl)-6-hydroxyhexanamide?
N-(6-aminohexyl)-6-hydroxyhexanamide has a molecular weight of 230.35 g/mol, XLogP of 1.17, 11 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-aminohexyl)-6-hydroxyhexanamide is sourced from PubChem (CID 3024494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).