5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine

C11H16N2O2 — CID 118192495

IUPAC5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine
SMILESCOC(OC)c1c(N)cncc1C1CC1
InChIInChI=1S/C11H16N2O2/c1-14-11(15-2)10-8(7-3-4-7)5-13-6-9(10)12/h5-7,11H,3-4,12H2,1-2H3
InChIKeyRKDVKBAGJNJNDB-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.83
Rot. Bonds4

About 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine

5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine (PubChem CID 118192495) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine.

Molecular Properties

Compound Name5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine
PubChem CID118192495
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine
SMILESCOC(OC)c1c(N)cncc1C1CC1
InChIInChI=1S/C11H16N2O2/c1-14-11(15-2)10-8(7-3-4-7)5-13-6-9(10)12/h5-7,11H,3-4,12H2,1-2H3
InChIKeyRKDVKBAGJNJNDB-UHFFFAOYSA-N
XLogP1.83
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine?
The IUPAC name of 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine (CID 118192495) is 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine.
What is the SMILES notation for 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine?
The canonical SMILES for 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine is COC(OC)c1c(N)cncc1C1CC1.
What is the InChIKey of 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine?
The InChIKey is RKDVKBAGJNJNDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-14-11(15-2)10-8(7-3-4-7)5-13-6-9(10)12/h5-7,11H,3-4,12H2,1-2H3.
What are the key properties of 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine?
5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine has a molecular weight of 208.26 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-4-(dimethoxymethyl)pyridin-3-amine is sourced from PubChem (CID 118192495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).