N,N-bis(2-aminoethoxy)aniline

C10H17N3O2 — CID 87691062

IUPACN,N-bis(2-aminoethoxy)aniline
SMILESNCCON(OCCN)c1ccccc1
InChIInChI=1S/C10H17N3O2/c11-6-8-14-13(15-9-7-12)10-4-2-1-3-5-10/h1-5H,6-9,11-12H2
InChIKeyKAXHVBOPSPXESB-UHFFFAOYSA-N
MW211.27 g/mol
LogP0.27
Rot. Bonds7

About N,N-bis(2-aminoethoxy)aniline

N,N-bis(2-aminoethoxy)aniline (PubChem CID 87691062) has the molecular formula C10H17N3O2 and a molecular weight of 211.27 g/mol. Its IUPAC name is N,N-bis(2-aminoethoxy)aniline.

Molecular Properties

Compound NameN,N-bis(2-aminoethoxy)aniline
PubChem CID87691062
Molecular FormulaC10H17N3O2
Molecular Weight211.27 g/mol
Exact Mass211.13
IUPAC NameN,N-bis(2-aminoethoxy)aniline
SMILESNCCON(OCCN)c1ccccc1
InChIInChI=1S/C10H17N3O2/c11-6-8-14-13(15-9-7-12)10-4-2-1-3-5-10/h1-5H,6-9,11-12H2
InChIKeyKAXHVBOPSPXESB-UHFFFAOYSA-N
XLogP0.27
TPSA73.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-(N-(4-aminophenoxy)anilino)oxyaniline
CID 87583777
O-[4-(N-phenylanilino)phenyl]hydroxylamine
CID 143364763
2-[2-(2-aminoethoxy)phenoxy]ethanamine
CID 2054448
N-(2-aminoethyl)-N-phenylnitrous amide;hydrochloride
CID 172990021
2-methoxyethanamine;toluene
CID 91320732
4-(2-iodoethoxy)-N,N-diphenylaniline
CID 163496028
2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide
CID 79480179
N-methyl-N-propoxyaniline
CID 14117102
ethane;2-phenylmethoxyethanamine
CID 142016503
4-ethoxy-N-(4-ethoxyphenyl)-N-phenylaniline
CID 18996804
2-[phenyl(phosphanyl)boranyl]oxyethanamine
CID 140793311
2-(2-aminoethyl)-N-methyl-N-phenylaniline
CID 63784561

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-aminoethoxy)aniline?
The IUPAC name of N,N-bis(2-aminoethoxy)aniline (CID 87691062) is N,N-bis(2-aminoethoxy)aniline.
What is the SMILES notation for N,N-bis(2-aminoethoxy)aniline?
The canonical SMILES for N,N-bis(2-aminoethoxy)aniline is NCCON(OCCN)c1ccccc1.
What is the InChIKey of N,N-bis(2-aminoethoxy)aniline?
The InChIKey is KAXHVBOPSPXESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c11-6-8-14-13(15-9-7-12)10-4-2-1-3-5-10/h1-5H,6-9,11-12H2.
What are the key properties of N,N-bis(2-aminoethoxy)aniline?
N,N-bis(2-aminoethoxy)aniline has a molecular weight of 211.27 g/mol, XLogP of 0.27, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-aminoethoxy)aniline is sourced from PubChem (CID 87691062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).