6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide

C14H31N3O4 — CID 178049768

IUPAC6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide
SMILESNCCCCCC(=O)NCCOCCOCCOCCN
InChIInChI=1S/C14H31N3O4/c15-5-3-1-2-4-14(18)17-7-9-20-11-13-21-12-10-19-8-6-16/h1-13,15-16H2,(H,17,18)
InChIKeyBRBIZWPPIXVSSB-UHFFFAOYSA-N
MW305.42 g/mol
LogP-0.37
Rot. Bonds16

About 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide

6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide (PubChem CID 178049768) has the molecular formula C14H31N3O4 and a molecular weight of 305.42 g/mol. Its IUPAC name is 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide.

Molecular Properties

Compound Name6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide
PubChem CID178049768
Molecular FormulaC14H31N3O4
Molecular Weight305.42 g/mol
Exact Mass305.23
IUPAC Name6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide
SMILESNCCCCCC(=O)NCCOCCOCCOCCN
InChIInChI=1S/C14H31N3O4/c15-5-3-1-2-4-14(18)17-7-9-20-11-13-21-12-10-19-8-6-16/h1-13,15-16H2,(H,17,18)
InChIKeyBRBIZWPPIXVSSB-UHFFFAOYSA-N
XLogP-0.37
TPSA108.83 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-9-hydroxynonanamide
CID 155740106
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]hexadecanamide
CID 87320335
16-amino-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]hexadecanamide;ethane
CID 145370854
7-amino-N-(2-but-3-enoxyethyl)heptanamide
CID 114183717
6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide
CID 106236522
N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]-6-azidohexanamide
CID 171532583
4-amino-N-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 145188206
2-[2-(5-aminopentanoylamino)ethoxy]acetic acid
CID 79457859
7-amino-N-[3-(2-hydroxyethoxy)propyl]heptanamide
CID 106310658
18-[[4-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethylamino]-4-oxobutyl]amino]-18-oxooctadecanoic acid
CID 145081788
N-[2-(2-aminoethoxy)ethyl]-5-(diaminomethylideneamino)pentanamide
CID 144951076
6-amino-N-(7-aminoheptyl)hexanamide
CID 56980494

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide?
The IUPAC name of 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide (CID 178049768) is 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide.
What is the SMILES notation for 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide?
The canonical SMILES for 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide is NCCCCCC(=O)NCCOCCOCCOCCN.
What is the InChIKey of 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide?
The InChIKey is BRBIZWPPIXVSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O4/c15-5-3-1-2-4-14(18)17-7-9-20-11-13-21-12-10-19-8-6-16/h1-13,15-16H2,(H,17,18).
What are the key properties of 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide?
6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide has a molecular weight of 305.42 g/mol, XLogP of -0.37, 16 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide is sourced from PubChem (CID 178049768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).