N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide

C17H20N2O2 — CID 21407384

IUPACN-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide
SMILESO=CNCCN(CCOc1ccccc1)c1ccccc1
InChIInChI=1S/C17H20N2O2/c20-15-18-11-12-19(16-7-3-1-4-8-16)13-14-21-17-9-5-2-6-10-17/h1-10,15H,11-14H2,(H,18,20)
InChIKeyXBQDWDKIKSSOJG-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.32
Rot. Bonds9

About N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide

N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide (PubChem CID 21407384) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide.

Molecular Properties

Compound NameN-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide
PubChem CID21407384
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide
SMILESO=CNCCN(CCOc1ccccc1)c1ccccc1
InChIInChI=1S/C17H20N2O2/c20-15-18-11-12-19(16-7-3-1-4-8-16)13-14-21-17-9-5-2-6-10-17/h1-10,15H,11-14H2,(H,18,20)
InChIKeyXBQDWDKIKSSOJG-UHFFFAOYSA-N
XLogP2.32
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[N-(2-formamidoethyl)anilino]ethyl phenyl carbonate
CID 21420240
[4-[2-[N-[2-(4-acetyloxyphenoxy)ethyl]anilino]ethoxy]phenyl] acetate
CID 71736094
N-[2-[N-[2-(4-bromo-2,5-dimethylthiophen-3-yl)ethyl]anilino]ethyl]formamide
CID 170129600
N-methyl-N-(2-phenoxyethyl)formamide
CID 64992361
N-ethyl-N-(2-phenoxyethyl)formamide
CID 54279086
N-[2-(4-bromophenoxy)ethyl]-N-ethylaniline
CID 55026790
N-(4-butoxyphenyl)-N'-ethyl-N'-phenylethane-1,2-diamine
CID 54806162
3-phenoxy-N-(3-phenoxypropyl)propan-1-amine;hydrochloride
CID 18793133
(2-formamido-4-phenoxybutyl) formate
CID 54572717
[4-[2-(N-ethylanilino)ethoxy]phenyl]-trimethylazanium
CID 54226224
N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-ethylaniline
CID 43253527
1,2-dimethyl-1-(2-phenoxyethyl)hydrazine
CID 144720052

Frequently Asked Questions

What is the IUPAC name of N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide?
The IUPAC name of N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide (CID 21407384) is N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide.
What is the SMILES notation for N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide?
The canonical SMILES for N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide is O=CNCCN(CCOc1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide?
The InChIKey is XBQDWDKIKSSOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-15-18-11-12-19(16-7-3-1-4-8-16)13-14-21-17-9-5-2-6-10-17/h1-10,15H,11-14H2,(H,18,20).
What are the key properties of N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide?
N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide has a molecular weight of 284.36 g/mol, XLogP of 2.32, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[N-(2-phenoxyethyl)anilino]ethyl]formamide is sourced from PubChem (CID 21407384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).