2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine

C16H20N2O2 — CID 60874271

IUPAC2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine
SMILESCCOc1cccc(CNc2cccnc2OCC)c1
InChIInChI=1S/C16H20N2O2/c1-3-19-14-8-5-7-13(11-14)12-18-15-9-6-10-17-16(15)20-4-2/h5-11,18H,3-4,12H2,1-2H3
InChIKeyLDDCEDOMXZOAAC-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.49
Rot. Bonds7

About 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine

2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine (PubChem CID 60874271) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine
PubChem CID60874271
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine
SMILESCCOc1cccc(CNc2cccnc2OCC)c1
InChIInChI=1S/C16H20N2O2/c1-3-19-14-8-5-7-13(11-14)12-18-15-9-6-10-17-16(15)20-4-2/h5-11,18H,3-4,12H2,1-2H3
InChIKeyLDDCEDOMXZOAAC-UHFFFAOYSA-N
XLogP3.49
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 43706224
2-ethoxy-N-[(4-ethoxyphenyl)methyl]pyridin-3-amine
CID 43706214
N-[(3,5-dimethoxyphenyl)methyl]-2-ethoxypyridin-3-amine
CID 43706520
2-methoxy-N-[(3-propoxyphenyl)methyl]pyridin-3-amine
CID 61016634
2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine
CID 43706225
N-[(3-chloro-4-methylphenyl)methyl]-2-ethoxypyridin-3-amine
CID 106816379
N-[(3-ethoxyphenyl)methyl]-2-methylsulfanylaniline
CID 60871982
2-ethoxy-N-[(4-propan-2-yloxyphenyl)methyl]pyridin-3-amine
CID 43784042
2-ethoxy-N-[[4-(trifluoromethyl)phenyl]methyl]pyridin-3-amine
CID 43706278
N-[(3-ethoxyphenyl)methyl]-2-(methoxymethyl)aniline
CID 60874269
2-ethoxy-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine
CID 66397464
N-[(3-ethoxyphenyl)methyl]-3-methylsulfonylpyridin-2-amine
CID 114598676

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine?
The IUPAC name of 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine (CID 60874271) is 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine.
What is the SMILES notation for 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine?
The canonical SMILES for 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine is CCOc1cccc(CNc2cccnc2OCC)c1.
What is the InChIKey of 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine?
The InChIKey is LDDCEDOMXZOAAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-3-19-14-8-5-7-13(11-14)12-18-15-9-6-10-17-16(15)20-4-2/h5-11,18H,3-4,12H2,1-2H3.
What are the key properties of 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine?
2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine has a molecular weight of 272.35 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine is sourced from PubChem (CID 60874271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).