5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine

C14H25N3 — CID 62281875

IUPAC5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine
SMILESCCNCc1ccc(N(C)C(C)C(C)C)nc1
InChIInChI=1S/C14H25N3/c1-6-15-9-13-7-8-14(16-10-13)17(5)12(4)11(2)3/h7-8,10-12,15H,6,9H2,1-5H3
InChIKeyWKPKMIPKQGEILK-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.67
Rot. Bonds6

About 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine

5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine (PubChem CID 62281875) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine
PubChem CID62281875
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine
SMILESCCNCc1ccc(N(C)C(C)C(C)C)nc1
InChIInChI=1S/C14H25N3/c1-6-15-9-13-7-8-14(16-10-13)17(5)12(4)11(2)3/h7-8,10-12,15H,6,9H2,1-5H3
InChIKeyWKPKMIPKQGEILK-UHFFFAOYSA-N
XLogP2.67
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine?
The IUPAC name of 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine (CID 62281875) is 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine?
The canonical SMILES for 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine is CCNCc1ccc(N(C)C(C)C(C)C)nc1.
What is the InChIKey of 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine?
The InChIKey is WKPKMIPKQGEILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-6-15-9-13-7-8-14(16-10-13)17(5)12(4)11(2)3/h7-8,10-12,15H,6,9H2,1-5H3.
What are the key properties of 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine?
5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine has a molecular weight of 235.37 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine is sourced from PubChem (CID 62281875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).