N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine

C15H18N2O — CID 28772700

IUPACN'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine
SMILESCN(CCN)c1ccccc1Oc1ccccc1
InChIInChI=1S/C15H18N2O/c1-17(12-11-16)14-9-5-6-10-15(14)18-13-7-3-2-4-8-13/h2-10H,11-12,16H2,1H3
InChIKeyIPLMDDYZTDREFQ-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.87
Rot. Bonds5

About N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine

N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine (PubChem CID 28772700) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine
PubChem CID28772700
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine
SMILESCN(CCN)c1ccccc1Oc1ccccc1
InChIInChI=1S/C15H18N2O/c1-17(12-11-16)14-9-5-6-10-15(14)18-13-7-3-2-4-8-13/h2-10H,11-12,16H2,1H3
InChIKeyIPLMDDYZTDREFQ-UHFFFAOYSA-N
XLogP2.87
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(2-Methoxyphenyl)piperazine hydrochloride
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Benzenamine, 2-phenoxy-
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1-(2-Ethoxyphenyl)piperazine
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Phenoxazine
CID 67278
1-[2-(Propan-2-yloxy)phenyl]piperazine
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1-(2-Methoxyphenyl)-4-propylpiperazine
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1-(2-(Benzyloxy)phenyl)piperazine
CID 22615724
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CID 3826471

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine?
The IUPAC name of N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine (CID 28772700) is N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine?
The canonical SMILES for N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine is CN(CCN)c1ccccc1Oc1ccccc1.
What is the InChIKey of N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine?
The InChIKey is IPLMDDYZTDREFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-17(12-11-16)14-9-5-6-10-15(14)18-13-7-3-2-4-8-13/h2-10H,11-12,16H2,1H3.
What are the key properties of N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine?
N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine has a molecular weight of 242.32 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-(2-phenoxyphenyl)ethane-1,2-diamine is sourced from PubChem (CID 28772700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).