3-(1-amino-2-methoxypentyl)pyridin-4-amine

C11H19N3O — CID 116718666

IUPAC3-(1-amino-2-methoxypentyl)pyridin-4-amine
SMILESCCCC(OC)C(N)c1cnccc1N
InChIInChI=1S/C11H19N3O/c1-3-4-10(15-2)11(13)8-7-14-6-5-9(8)12/h5-7,10-11H,3-4,13H2,1-2H3,(H2,12,14)
InChIKeySADQCEHODQVVAB-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.48
Rot. Bonds5

About 3-(1-amino-2-methoxypentyl)pyridin-4-amine

3-(1-amino-2-methoxypentyl)pyridin-4-amine (PubChem CID 116718666) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-(1-amino-2-methoxypentyl)pyridin-4-amine.

Molecular Properties

Compound Name3-(1-amino-2-methoxypentyl)pyridin-4-amine
PubChem CID116718666
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-(1-amino-2-methoxypentyl)pyridin-4-amine
SMILESCCCC(OC)C(N)c1cnccc1N
InChIInChI=1S/C11H19N3O/c1-3-4-10(15-2)11(13)8-7-14-6-5-9(8)12/h5-7,10-11H,3-4,13H2,1-2H3,(H2,12,14)
InChIKeySADQCEHODQVVAB-UHFFFAOYSA-N
XLogP1.48
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1-amino-3-ethoxypropyl)pyridin-4-amine
CID 106815066
2-ethoxy-1-isoquinolin-8-ylpentan-1-amine
CID 103143794
3-[3-methoxy-1-(propylamino)butyl]pyridin-4-amine
CID 113391490
1-(4-amino-3-pyridinyl)-4-methoxybutan-1-ol
CID 65092313
3-(1-chloro-2-methylpropyl)pyridin-4-amine
CID 130480173
3-[2-ethyl-2-methoxy-1-(methylamino)butyl]pyridin-4-amine
CID 116760962
1-(3-methoxy-4-pyridinyl)propan-1-amine
CID 105065142
3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine
CID 116773275
3-[3-ethoxy-1-(propylamino)propyl]pyridin-4-amine
CID 106815087
1-(3-chlorothiophen-2-yl)-2-methoxypentan-1-amine
CID 107360210
1-isoquinolin-8-yl-2-methoxy-N-methylpentan-1-amine
CID 103143798
3-(2-hydrazinyl-3-methoxypentyl)pyridin-4-amine
CID 105270886

Frequently Asked Questions

What is the IUPAC name of 3-(1-amino-2-methoxypentyl)pyridin-4-amine?
The IUPAC name of 3-(1-amino-2-methoxypentyl)pyridin-4-amine (CID 116718666) is 3-(1-amino-2-methoxypentyl)pyridin-4-amine.
What is the SMILES notation for 3-(1-amino-2-methoxypentyl)pyridin-4-amine?
The canonical SMILES for 3-(1-amino-2-methoxypentyl)pyridin-4-amine is CCCC(OC)C(N)c1cnccc1N.
What is the InChIKey of 3-(1-amino-2-methoxypentyl)pyridin-4-amine?
The InChIKey is SADQCEHODQVVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-4-10(15-2)11(13)8-7-14-6-5-9(8)12/h5-7,10-11H,3-4,13H2,1-2H3,(H2,12,14).
What are the key properties of 3-(1-amino-2-methoxypentyl)pyridin-4-amine?
3-(1-amino-2-methoxypentyl)pyridin-4-amine has a molecular weight of 209.29 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-amino-2-methoxypentyl)pyridin-4-amine is sourced from PubChem (CID 116718666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).