[4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine

C12H18N2O — CID 106205679

IUPAC[4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine
SMILESNCc1cnccc1OCCC1CCC1
InChIInChI=1S/C12H18N2O/c13-8-11-9-14-6-4-12(11)15-7-5-10-2-1-3-10/h4,6,9-10H,1-3,5,7-8,13H2
InChIKeyRKNGLNWWQCJLJN-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.11
Rot. Bonds5

About [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine

[4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine (PubChem CID 106205679) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine
PubChem CID106205679
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name[4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine
SMILESNCc1cnccc1OCCC1CCC1
InChIInChI=1S/C12H18N2O/c13-8-11-9-14-6-4-12(11)15-7-5-10-2-1-3-10/h4,6,9-10H,1-3,5,7-8,13H2
InChIKeyRKNGLNWWQCJLJN-UHFFFAOYSA-N
XLogP2.11
TPSA48.14 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 ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(2-cyclobutylethoxy)-5-fluorophenyl]methanamine
CID 106199490
[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-3-pyridinyl]methanamine
CID 112589639
[4-(3-methylbutoxy)-3-pyridinyl]methanamine
CID 81255354
[2-[2-(2-cyclobutylethoxy)ethoxy]phenyl]methanamine
CID 114157332
[4-[(1-methylpiperidin-2-yl)methoxy]-3-pyridinyl]methanamine
CID 81250968
[4-[(1-methylcyclobutyl)methoxy]-3-pyridinyl]methanamine
CID 132587623
4-(2-cyclopentylethoxy)pyridine
CID 91320777
[2-[3-(2-cyclopropylethoxy)propoxy]phenyl]methanamine
CID 114157324
4-(2-cyclopropylethoxy)pyridine
CID 174949801
[4-(2-methylcyclohexyl)oxy-3-pyridinyl]methanamine
CID 81254856
[4-(2-phenylmethoxyethoxy)-3-pyridinyl]methanamine
CID 132587694
(4-cyclobutyl-3-pyridinyl)methanamine
CID 83914283

Frequently Asked Questions

What is the IUPAC name of [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine?
The IUPAC name of [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine (CID 106205679) is [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine is NCc1cnccc1OCCC1CCC1.
What is the InChIKey of [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine?
The InChIKey is RKNGLNWWQCJLJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c13-8-11-9-14-6-4-12(11)15-7-5-10-2-1-3-10/h4,6,9-10H,1-3,5,7-8,13H2.
What are the key properties of [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine?
[4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine has a molecular weight of 206.29 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-cyclobutylethoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 106205679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).