2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine

C16H20N2O — CID 43706225

IUPAC2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine
SMILESCCOc1ncccc1NCc1ccc(CC)cc1
InChIInChI=1S/C16H20N2O/c1-3-13-7-9-14(10-8-13)12-18-15-6-5-11-17-16(15)19-4-2/h5-11,18H,3-4,12H2,1-2H3
InChIKeyRUMRGKONEAQZAM-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.65
Rot. Bonds6

About 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine

2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine (PubChem CID 43706225) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine
PubChem CID43706225
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine
SMILESCCOc1ncccc1NCc1ccc(CC)cc1
InChIInChI=1S/C16H20N2O/c1-3-13-7-9-14(10-8-13)12-18-15-6-5-11-17-16(15)19-4-2/h5-11,18H,3-4,12H2,1-2H3
InChIKeyRUMRGKONEAQZAM-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

2-ethoxy-N-[(4-ethoxyphenyl)methyl]pyridin-3-amine
CID 43706214
2-ethoxy-N-[[4-(trifluoromethyl)phenyl]methyl]pyridin-3-amine
CID 43706278
2-ethoxy-N-[(4-propan-2-yloxyphenyl)methyl]pyridin-3-amine
CID 43784042
2-ethoxy-N-[(4-nitrophenyl)methyl]pyridin-3-amine
CID 43706113
N-[(3,5-dimethoxyphenyl)methyl]-2-ethoxypyridin-3-amine
CID 43706520
2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 43706224
2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine
CID 60874271
N-[(3-chloro-4-methylphenyl)methyl]-2-ethoxypyridin-3-amine
CID 106816379
2-ethoxy-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine
CID 66397464
2-ethoxy-N-[(2-methylphenyl)methyl]pyridin-3-amine
CID 43706219
2-ethoxy-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 43706255
2-ethoxy-N-[(1-propylpyrrol-3-yl)methyl]pyridin-3-amine
CID 66414540

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine?
The IUPAC name of 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine (CID 43706225) is 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine.
What is the SMILES notation for 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine?
The canonical SMILES for 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine is CCOc1ncccc1NCc1ccc(CC)cc1.
What is the InChIKey of 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine?
The InChIKey is RUMRGKONEAQZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-3-13-7-9-14(10-8-13)12-18-15-6-5-11-17-16(15)19-4-2/h5-11,18H,3-4,12H2,1-2H3.
What are the key properties of 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine?
2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-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 2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine is sourced from PubChem (CID 43706225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).