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

C15H18N2O — CID 43706224

IUPAC2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine
SMILESCCOc1ncccc1NCc1cccc(C)c1
InChIInChI=1S/C15H18N2O/c1-3-18-15-14(8-5-9-16-15)17-11-13-7-4-6-12(2)10-13/h4-10,17H,3,11H2,1-2H3
InChIKeyKAOYXJRVYCJQKA-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.40
Rot. Bonds5

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

2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine (PubChem CID 43706224) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine
PubChem CID43706224
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine
SMILESCCOc1ncccc1NCc1cccc(C)c1
InChIInChI=1S/C15H18N2O/c1-3-18-15-14(8-5-9-16-15)17-11-13-7-4-6-12(2)10-13/h4-10,17H,3,11H2,1-2H3
InChIKeyKAOYXJRVYCJQKA-UHFFFAOYSA-N
XLogP3.40
TPSA34.15 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 ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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-[(4-ethylphenyl)methyl]pyridin-3-amine
CID 43706225
2-ethoxy-N-[(4-ethoxyphenyl)methyl]pyridin-3-amine
CID 43706214
2-chloro-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 43689842
N-[(3,5-dimethoxyphenyl)methyl]-2-ethoxypyridin-3-amine
CID 43706520
2-ethoxy-N-[[4-(trifluoromethyl)phenyl]methyl]pyridin-3-amine
CID 43706278
2-ethoxy-N-[(2-methylphenyl)methyl]pyridin-3-amine
CID 43706219
2-ethoxy-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine
CID 66397464
4-ethoxy-2-methyl-N-[(3-methylphenyl)methyl]aniline
CID 54865409
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-ethoxypyridin-3-amine
CID 43706464
2-ethoxy-N-[(4-propan-2-yloxyphenyl)methyl]pyridin-3-amine
CID 43784042

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine?
The IUPAC name of 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine (CID 43706224) is 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine.
What is the SMILES notation for 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine?
The canonical SMILES for 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine is CCOc1ncccc1NCc1cccc(C)c1.
What is the InChIKey of 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine?
The InChIKey is KAOYXJRVYCJQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-3-18-15-14(8-5-9-16-15)17-11-13-7-4-6-12(2)10-13/h4-10,17H,3,11H2,1-2H3.
What are the key properties of 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine?
2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine has a molecular weight of 242.32 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine is sourced from PubChem (CID 43706224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).