2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine

C18H24N2O — CID 107875958

IUPAC2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine
SMILESCCOc1ncccc1NCC(c1ccccc1)C(C)C
InChIInChI=1S/C18H24N2O/c1-4-21-18-17(11-8-12-19-18)20-13-16(14(2)3)15-9-6-5-7-10-15/h5-12,14,16,20H,4,13H2,1-3H3
InChIKeyUJPRYPLEYHBPMH-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.33
Rot. Bonds7

About 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine

2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine (PubChem CID 107875958) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine.

Molecular Properties

Compound Name2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine
PubChem CID107875958
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine
SMILESCCOc1ncccc1NCC(c1ccccc1)C(C)C
InChIInChI=1S/C18H24N2O/c1-4-21-18-17(11-8-12-19-18)20-13-16(14(2)3)15-9-6-5-7-10-15/h5-12,14,16,20H,4,13H2,1-3H3
InChIKeyUJPRYPLEYHBPMH-UHFFFAOYSA-N
XLogP4.33
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(3-methyl-2-phenylbutyl)aniline
CID 107875833
N-(3-methyl-2-phenylbutyl)-2-methylsulfanylaniline
CID 107875943
N-[(2-methoxy-3-pyridinyl)methyl]-3-methyl-2-phenylbutan-1-amine
CID 107876007
2-ethoxy-N-(3-methoxybutan-2-yl)pyridin-3-amine
CID 115922159
2-amino-N-(2-ethoxy-3-pyridinyl)-2-phenylacetamide
CID 43706621
2-[(2-ethoxy-3-pyridinyl)amino]propanoic acid
CID 66173717
2-ethoxy-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 43706285
2-ethoxy-N-[(2-methylphenyl)methyl]pyridin-3-amine
CID 43706219
4-methyl-N-(3-methyl-2-phenylbutyl)pyridin-3-amine
CID 107876162
2-N-(2-ethoxy-3-pyridinyl)propane-1,2-diamine
CID 103388376
2-ethoxy-N-octylpyridin-3-amine
CID 43706171
2-ethoxy-N-[(4-ethylphenyl)methyl]pyridin-3-amine
CID 43706225

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine?
The IUPAC name of 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine (CID 107875958) is 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine.
What is the SMILES notation for 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine?
The canonical SMILES for 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine is CCOc1ncccc1NCC(c1ccccc1)C(C)C.
What is the InChIKey of 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine?
The InChIKey is UJPRYPLEYHBPMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-4-21-18-17(11-8-12-19-18)20-13-16(14(2)3)15-9-6-5-7-10-15/h5-12,14,16,20H,4,13H2,1-3H3.
What are the key properties of 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine?
2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine has a molecular weight of 284.40 g/mol, XLogP of 4.33, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(3-methyl-2-phenylbutyl)pyridin-3-amine is sourced from PubChem (CID 107875958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).