6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine

C13H23N3O — CID 113325043

IUPAC6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine
SMILESCC(C)N(CCOc1cccc(N)n1)C(C)C
InChIInChI=1S/C13H23N3O/c1-10(2)16(11(3)4)8-9-17-13-7-5-6-12(14)15-13/h5-7,10-11H,8-9H2,1-4H3,(H2,14,15)
InChIKeyPLXUWRZGMCALIV-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.16
Rot. Bonds6

About 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine

6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine (PubChem CID 113325043) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine.

Molecular Properties

Compound Name6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine
PubChem CID113325043
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine
SMILESCC(C)N(CCOc1cccc(N)n1)C(C)C
InChIInChI=1S/C13H23N3O/c1-10(2)16(11(3)4)8-9-17-13-7-5-6-12(14)15-13/h5-7,10-11H,8-9H2,1-4H3,(H2,14,15)
InChIKeyPLXUWRZGMCALIV-UHFFFAOYSA-N
XLogP2.16
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine?
The IUPAC name of 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine (CID 113325043) is 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine.
What is the SMILES notation for 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine?
The canonical SMILES for 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine is CC(C)N(CCOc1cccc(N)n1)C(C)C.
What is the InChIKey of 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine?
The InChIKey is PLXUWRZGMCALIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-10(2)16(11(3)4)8-9-17-13-7-5-6-12(14)15-13/h5-7,10-11H,8-9H2,1-4H3,(H2,14,15).
What are the key properties of 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine?
6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine has a molecular weight of 237.35 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[di(propan-2-yl)amino]ethoxy]pyridin-2-amine is sourced from PubChem (CID 113325043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).