6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

C14H25N3O2 — CID 61104417

IUPAC6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCN(C)CCCOc1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C14H25N3O2/c1-14(2,3)19-13-11(15)7-8-12(16-13)18-10-6-9-17(4)5/h7-8H,6,9-10,15H2,1-5H3
InChIKeyNAWBFYHEUMSIDL-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.17
Rot. Bonds6

About 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (PubChem CID 61104417) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
PubChem CID61104417
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCN(C)CCCOc1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C14H25N3O2/c1-14(2,3)19-13-11(15)7-8-12(16-13)18-10-6-9-17(4)5/h7-8H,6,9-10,15H2,1-5H3
InChIKeyNAWBFYHEUMSIDL-UHFFFAOYSA-N
XLogP2.17
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (CID 61104417) is 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is CN(C)CCCOc1ccc(N)c(OC(C)(C)C)n1.
What is the InChIKey of 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The InChIKey is NAWBFYHEUMSIDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-14(2,3)19-13-11(15)7-8-12(16-13)18-10-6-9-17(4)5/h7-8H,6,9-10,15H2,1-5H3.
What are the key properties of 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine has a molecular weight of 267.37 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(dimethylamino)propoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 61104417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).