3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine

C13H23N3O — CID 116715605

IUPAC3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine
SMILESCCNC(c1cc(C)cnc1N)C(CC)OC
InChIInChI=1S/C13H23N3O/c1-5-11(17-4)12(15-6-2)10-7-9(3)8-16-13(10)14/h7-8,11-12,15H,5-6H2,1-4H3,(H2,14,16)
InChIKeyWWNSYGMVDMPYIB-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.05
Rot. Bonds6

About 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine

3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine (PubChem CID 116715605) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine
PubChem CID116715605
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine
SMILESCCNC(c1cc(C)cnc1N)C(CC)OC
InChIInChI=1S/C13H23N3O/c1-5-11(17-4)12(15-6-2)10-7-9(3)8-16-13(10)14/h7-8,11-12,15H,5-6H2,1-4H3,(H2,14,16)
InChIKeyWWNSYGMVDMPYIB-UHFFFAOYSA-N
XLogP2.05
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[1-(ethylamino)-2,2-dimethoxyethyl]-5-methylpyridin-2-amine
CID 79493469
3-(1-hydrazinylpropyl)-5-methylpyridin-2-amine
CID 105201163
3-[2,2-diethoxy-1-(propylamino)ethyl]-5-methylpyridin-2-amine
CID 79495031
3-(2-ethoxy-1-hydrazinylpropyl)-5-methylpyridin-2-amine
CID 105223027
3-(2-ethoxy-1-hydrazinylpentyl)-5-methylpyridin-2-amine
CID 105271559
3-[(4-bromo-3,5-dimethylphenyl)-(ethylamino)methyl]-5-methylpyridin-2-amine
CID 114330580
3-(2-ethoxy-1-hydrazinyl-3-methylbutyl)-5-methylpyridin-2-amine
CID 105272591
3-(2-cyclopropyl-1-hydrazinyl-2-methoxyethyl)-5-methylpyridin-2-amine
CID 105272937
5-methyl-3-pentan-2-ylpyridin-2-amine
CID 107887874
3-(1-hydrazinylbutyl)-5-methylpyridin-2-amine
CID 105202307
3-(1-amino-2-ethoxy-3-methylbutyl)-5-methylpyridin-2-amine
CID 116720727
1-(2,5-dimethoxyphenyl)-N-ethyl-2-methoxybutan-1-amine
CID 116715821

Frequently Asked Questions

What is the IUPAC name of 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine?
The IUPAC name of 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine (CID 116715605) is 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine.
What is the SMILES notation for 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine?
The canonical SMILES for 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine is CCNC(c1cc(C)cnc1N)C(CC)OC.
What is the InChIKey of 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine?
The InChIKey is WWNSYGMVDMPYIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-5-11(17-4)12(15-6-2)10-7-9(3)8-16-13(10)14/h7-8,11-12,15H,5-6H2,1-4H3,(H2,14,16).
What are the key properties of 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine?
3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine has a molecular weight of 237.35 g/mol, XLogP of 2.05, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(ethylamino)-2-methoxybutyl]-5-methylpyridin-2-amine is sourced from PubChem (CID 116715605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).