6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide

C10H21N3O3 — CID 106236522

IUPAC6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide
SMILESNCCCCCC(=O)NCCOCC(N)=O
InChIInChI=1S/C10H21N3O3/c11-5-3-1-2-4-10(15)13-6-7-16-8-9(12)14/h1-8,11H2,(H2,12,14)(H,13,15)
InChIKeyVUKYEPVSLCEOKH-UHFFFAOYSA-N
MW231.30 g/mol
LogP-0.88
Rot. Bonds10

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

6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide (PubChem CID 106236522) has the molecular formula C10H21N3O3 and a molecular weight of 231.30 g/mol. Its IUPAC name is 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide.

Molecular Properties

Compound Name6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide
PubChem CID106236522
Molecular FormulaC10H21N3O3
Molecular Weight231.30 g/mol
Exact Mass231.16
IUPAC Name6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide
SMILESNCCCCCC(=O)NCCOCC(N)=O
InChIInChI=1S/C10H21N3O3/c11-5-3-1-2-4-10(15)13-6-7-16-8-9(12)14/h1-8,11H2,(H2,12,14)(H,13,15)
InChIKeyVUKYEPVSLCEOKH-UHFFFAOYSA-N
XLogP-0.88
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 5-0.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(5-aminopentanoylamino)ethoxy]acetic acid
CID 79457859
6-amino-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]hexanamide
CID 178049768
16-amino-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]hexadecanamide;ethane
CID 145370854
6-amino-N-(5-amino-5-oxopentyl)hexanamide
CID 106235898
7-amino-N-(2-but-3-enoxyethyl)heptanamide
CID 114183717
6-amino-N-(7-aminoheptyl)hexanamide
CID 56980494
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]hexadecanamide
CID 87320335
4-amino-N-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 145188206
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-9-hydroxynonanamide
CID 155740106
7-amino-N-[3-(2-hydroxyethoxy)propyl]heptanamide
CID 106310658
2-[2-(hexadecanoylamino)ethoxy]acetic acid
CID 3017701

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide?
The IUPAC name of 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide (CID 106236522) is 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide.
What is the SMILES notation for 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide?
The canonical SMILES for 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide is NCCCCCC(=O)NCCOCC(N)=O.
What is the InChIKey of 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide?
The InChIKey is VUKYEPVSLCEOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3/c11-5-3-1-2-4-10(15)13-6-7-16-8-9(12)14/h1-8,11H2,(H2,12,14)(H,13,15).
What are the key properties of 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide?
6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide has a molecular weight of 231.30 g/mol, XLogP of -0.88, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]hexanamide is sourced from PubChem (CID 106236522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).