5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine

C12H18N2O — CID 62188543

IUPAC5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine
SMILESCCNc1ccc(COC2CCC2)cn1
InChIInChI=1S/C12H18N2O/c1-2-13-12-7-6-10(8-14-12)9-15-11-4-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,13,14)
InChIKeyPXOGIOOUDDSUTC-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.58
Rot. Bonds5

About 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine

5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine (PubChem CID 62188543) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine
PubChem CID62188543
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine
SMILESCCNc1ccc(COC2CCC2)cn1
InChIInChI=1S/C12H18N2O/c1-2-13-12-7-6-10(8-14-12)9-15-11-4-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,13,14)
InChIKeyPXOGIOOUDDSUTC-UHFFFAOYSA-N
XLogP2.58
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine?
The IUPAC name of 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine (CID 62188543) is 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine?
The canonical SMILES for 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine is CCNc1ccc(COC2CCC2)cn1.
What is the InChIKey of 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine?
The InChIKey is PXOGIOOUDDSUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-2-13-12-7-6-10(8-14-12)9-15-11-4-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,13,14).
What are the key properties of 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine?
5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine has a molecular weight of 206.29 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclobutyloxymethyl)-N-ethylpyridin-2-amine is sourced from PubChem (CID 62188543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).