5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine

C13H23N3 — CID 81248626

IUPAC5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine
SMILESCCCN(C)c1cc(C)ncc1CNCC
InChIInChI=1S/C13H23N3/c1-5-7-16(4)13-8-11(3)15-10-12(13)9-14-6-2/h8,10,14H,5-7,9H2,1-4H3
InChIKeyFZYZVXUYHCUYNM-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.35
Rot. Bonds6

About 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine

5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine (PubChem CID 81248626) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine
PubChem CID81248626
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine
SMILESCCCN(C)c1cc(C)ncc1CNCC
InChIInChI=1S/C13H23N3/c1-5-7-16(4)13-8-11(3)15-10-12(13)9-14-6-2/h8,10,14H,5-7,9H2,1-4H3
InChIKeyFZYZVXUYHCUYNM-UHFFFAOYSA-N
XLogP2.35
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine?
The IUPAC name of 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine (CID 81248626) is 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine?
The canonical SMILES for 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine is CCCN(C)c1cc(C)ncc1CNCC.
What is the InChIKey of 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine?
The InChIKey is FZYZVXUYHCUYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-5-7-16(4)13-8-11(3)15-10-12(13)9-14-6-2/h8,10,14H,5-7,9H2,1-4H3.
What are the key properties of 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine?
5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine has a molecular weight of 221.35 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine is sourced from PubChem (CID 81248626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).