N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine

C14H25N3 — CID 81249866

IUPACN-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine
SMILESCCCN(CC)c1cc(C)ncc1CNCC
InChIInChI=1S/C14H25N3/c1-5-8-17(7-3)14-9-12(4)16-11-13(14)10-15-6-2/h9,11,15H,5-8,10H2,1-4H3
InChIKeyPKYKIBVPIHDIEE-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.74
Rot. Bonds7

About N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine

N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine (PubChem CID 81249866) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine.

Molecular Properties

Compound NameN-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine
PubChem CID81249866
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine
SMILESCCCN(CC)c1cc(C)ncc1CNCC
InChIInChI=1S/C14H25N3/c1-5-8-17(7-3)14-9-12(4)16-11-13(14)10-15-6-2/h9,11,15H,5-8,10H2,1-4H3
InChIKeyPKYKIBVPIHDIEE-UHFFFAOYSA-N
XLogP2.74
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine?
The IUPAC name of N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine (CID 81249866) is N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine.
What is the SMILES notation for N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine?
The canonical SMILES for N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine is CCCN(CC)c1cc(C)ncc1CNCC.
What is the InChIKey of N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine?
The InChIKey is PKYKIBVPIHDIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-5-8-17(7-3)14-9-12(4)16-11-13(14)10-15-6-2/h9,11,15H,5-8,10H2,1-4H3.
What are the key properties of N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine?
N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine has a molecular weight of 235.37 g/mol, XLogP of 2.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(ethylaminomethyl)-2-methyl-N-propylpyridin-4-amine is sourced from PubChem (CID 81249866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).