N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine

C16H20N2O — CID 79239613

IUPACN-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine
SMILESCCNc1cccc(COc2cccc(CC)c2)n1
InChIInChI=1S/C16H20N2O/c1-3-13-7-5-9-15(11-13)19-12-14-8-6-10-16(18-14)17-4-2/h5-11H,3-4,12H2,1-2H3,(H,17,18)
InChIKeyCAQDMOKASHIFIO-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.65
Rot. Bonds6

About N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine

N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine (PubChem CID 79239613) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine
PubChem CID79239613
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine
SMILESCCNc1cccc(COc2cccc(CC)c2)n1
InChIInChI=1S/C16H20N2O/c1-3-13-7-5-9-15(11-13)19-12-14-8-6-10-16(18-14)17-4-2/h5-11H,3-4,12H2,1-2H3,(H,17,18)
InChIKeyCAQDMOKASHIFIO-UHFFFAOYSA-N
XLogP3.65
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-6-(naphthalen-2-yloxymethyl)pyridin-2-amine
CID 79231800
6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine
CID 79239120
[3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol
CID 79238949
2-chloro-6-[(3-ethylphenoxy)methyl]pyridine
CID 79240680
6-[(3-ethylphenoxy)methyl]pyridin-2-amine
CID 79239703
6-[(4-tert-butylphenoxy)methyl]-N-ethylpyridin-2-amine
CID 79231253
N-ethyl-5-[(3-ethylphenoxy)methyl]pyridin-2-amine
CID 62195699
N-ethyl-6-[(4-propoxyphenoxy)methyl]pyridin-2-amine
CID 79232344
N-ethyl-6-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine
CID 79232071
[6-[(3-tert-butylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 79230468
N-[[4-[(3-ethylphenoxy)methyl]-1,3-thiazol-2-yl]methyl]-2-methylpropan-2-amine
CID 62450130
6-[(3-bromophenoxy)methyl]-N-methylpyridin-2-amine
CID 79239184

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine (CID 79239613) is N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine is CCNc1cccc(COc2cccc(CC)c2)n1.
What is the InChIKey of N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine?
The InChIKey is CAQDMOKASHIFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-3-13-7-5-9-15(11-13)19-12-14-8-6-10-16(18-14)17-4-2/h5-11H,3-4,12H2,1-2H3,(H,17,18).
What are the key properties of N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine?
N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine is sourced from PubChem (CID 79239613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).