4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine

C11H18N2O2 — CID 106446734

IUPAC4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine
SMILESCC(C)COCCOc1ccncc1N
InChIInChI=1S/C11H18N2O2/c1-9(2)8-14-5-6-15-11-3-4-13-7-10(11)12/h3-4,7,9H,5-6,8,12H2,1-2H3
InChIKeyDJXGEJLRFIZYPE-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.72
Rot. Bonds6

About 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine

4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine (PubChem CID 106446734) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine.

Molecular Properties

Compound Name4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine
PubChem CID106446734
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine
SMILESCC(C)COCCOc1ccncc1N
InChIInChI=1S/C11H18N2O2/c1-9(2)8-14-5-6-15-11-3-4-13-7-10(11)12/h3-4,7,9H,5-6,8,12H2,1-2H3
InChIKeyDJXGEJLRFIZYPE-UHFFFAOYSA-N
XLogP1.72
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-[2-(2-methylpropoxy)ethoxy]isoquinolin-8-amine
CID 106446795
4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine
CID 104559949
4-(3-methoxy-3-methylbutoxy)pyridin-3-amine
CID 106664857
4-fluoro-2-[2-(2-methylpropoxy)ethoxy]aniline
CID 106446718
2-[2-(2-methylpropoxy)ethoxy]-5-(trifluoromethyl)aniline
CID 106446774
4-(2,2-dimethylpropoxy)pyridin-3-amine
CID 97181806
3-amino-N-methyl-4-[2-(2-methylpropoxy)ethoxy]benzenesulfonamide
CID 106446796
4-amino-2-[2-(2-methylpropoxy)ethoxy]benzoic acid
CID 106448425
2-methyl-4-[2-(2-methylpropoxy)ethoxy]-5-propan-2-ylaniline
CID 106449346
4-(2-piperidin-1-ylethoxy)pyridin-3-amine
CID 61102870
6-(2-methylpropoxy)isoquinolin-5-amine
CID 106948601
5-chloro-2-[2-(2-methylpropoxy)ethoxy]pyridine
CID 106448551

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine?
The IUPAC name of 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine (CID 106446734) is 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine.
What is the SMILES notation for 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine?
The canonical SMILES for 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine is CC(C)COCCOc1ccncc1N.
What is the InChIKey of 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine?
The InChIKey is DJXGEJLRFIZYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-9(2)8-14-5-6-15-11-3-4-13-7-10(11)12/h3-4,7,9H,5-6,8,12H2,1-2H3.
What are the key properties of 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine?
4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine has a molecular weight of 210.28 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methylpropoxy)ethoxy]pyridin-3-amine is sourced from PubChem (CID 106446734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).