4-(2-propoxyethoxymethyl)pyridin-2-amine

C11H18N2O2 — CID 63684235

IUPAC4-(2-propoxyethoxymethyl)pyridin-2-amine
SMILESCCCOCCOCc1ccnc(N)c1
InChIInChI=1S/C11H18N2O2/c1-2-5-14-6-7-15-9-10-3-4-13-11(12)8-10/h3-4,8H,2,5-7,9H2,1H3,(H2,12,13)
InChIKeyXQDIXNWVHMTQBX-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.61
Rot. Bonds7

About 4-(2-propoxyethoxymethyl)pyridin-2-amine

4-(2-propoxyethoxymethyl)pyridin-2-amine (PubChem CID 63684235) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-(2-propoxyethoxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name4-(2-propoxyethoxymethyl)pyridin-2-amine
PubChem CID63684235
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name4-(2-propoxyethoxymethyl)pyridin-2-amine
SMILESCCCOCCOCc1ccnc(N)c1
InChIInChI=1S/C11H18N2O2/c1-2-5-14-6-7-15-9-10-3-4-13-11(12)8-10/h3-4,8H,2,5-7,9H2,1H3,(H2,12,13)
InChIKeyXQDIXNWVHMTQBX-UHFFFAOYSA-N
XLogP1.61
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.61
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

4-(heptoxymethyl)pyridin-2-amine
CID 62465689
2-chloro-4-(2-propoxyethoxymethyl)pyridine
CID 63684727
[4-(propoxymethyl)-2-pyridinyl]methanamine
CID 63887669
4-[(3-methoxy-3-methylbutoxy)methyl]pyridin-2-amine
CID 106667203
N-methyl-4-(propoxymethyl)pyridin-2-amine
CID 62466206
4-(propoxymethyl)pyridine-2-carbonitrile
CID 63884045
4-(2,2-dimethoxyethoxymethyl)pyridin-2-amine
CID 171796381
ethane;4-ethylpyridin-2-amine
CID 144736585
(2-amino-4-pyridinyl)methyl propanoate
CID 166101515
4-(2-methylbutan-2-yloxymethyl)pyridin-2-amine
CID 62465833
4-[(3,5-dimethylphenoxy)methyl]pyridin-2-amine
CID 62465468
2-ethyl-5-(propoxymethyl)aniline
CID 12708575

Frequently Asked Questions

What is the IUPAC name of 4-(2-propoxyethoxymethyl)pyridin-2-amine?
The IUPAC name of 4-(2-propoxyethoxymethyl)pyridin-2-amine (CID 63684235) is 4-(2-propoxyethoxymethyl)pyridin-2-amine.
What is the SMILES notation for 4-(2-propoxyethoxymethyl)pyridin-2-amine?
The canonical SMILES for 4-(2-propoxyethoxymethyl)pyridin-2-amine is CCCOCCOCc1ccnc(N)c1.
What is the InChIKey of 4-(2-propoxyethoxymethyl)pyridin-2-amine?
The InChIKey is XQDIXNWVHMTQBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-2-5-14-6-7-15-9-10-3-4-13-11(12)8-10/h3-4,8H,2,5-7,9H2,1H3,(H2,12,13).
What are the key properties of 4-(2-propoxyethoxymethyl)pyridin-2-amine?
4-(2-propoxyethoxymethyl)pyridin-2-amine has a molecular weight of 210.28 g/mol, XLogP of 1.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-propoxyethoxymethyl)pyridin-2-amine is sourced from PubChem (CID 63684235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).