2-[(3-ethylcyclobutyl)oxymethyl]pyridine

C12H17NO — CID 170582773

IUPAC2-[(3-ethylcyclobutyl)oxymethyl]pyridine
SMILESCCC1CC(OCc2ccccn2)C1
InChIInChI=1S/C12H17NO/c1-2-10-7-12(8-10)14-9-11-5-3-4-6-13-11/h3-6,10,12H,2,7-9H2,1H3
InChIKeyPAEKYESFKDEXQZ-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.79
Rot. Bonds4

About 2-[(3-ethylcyclobutyl)oxymethyl]pyridine

2-[(3-ethylcyclobutyl)oxymethyl]pyridine (PubChem CID 170582773) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-[(3-ethylcyclobutyl)oxymethyl]pyridine.

Molecular Properties

Compound Name2-[(3-ethylcyclobutyl)oxymethyl]pyridine
PubChem CID170582773
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-[(3-ethylcyclobutyl)oxymethyl]pyridine
SMILESCCC1CC(OCc2ccccn2)C1
InChIInChI=1S/C12H17NO/c1-2-10-7-12(8-10)14-9-11-5-3-4-6-13-11/h3-6,10,12H,2,7-9H2,1H3
InChIKeyPAEKYESFKDEXQZ-UHFFFAOYSA-N
XLogP2.79
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1-propan-2-ylpiperidin-4-yl)oxymethyl]pyridine
CID 134434529
2-[[(1S,8R,9S,16R)-16-(pyridin-2-ylmethoxy)-8-tetracyclo[7.7.1.02,7.010,15]heptadeca-2,4,6,10,12,14-hexaenyl]oxymethyl]pyridine
CID 102258546
7-(pyridin-2-ylmethoxy)-5-thia-2-azaspiro[3.4]octane
CID 131647834
(3R)-8-methyl-3-(pyridin-2-ylmethoxy)-1-oxa-8-azaspiro[4.5]decane
CID 97419146
[(2R,3S,4S,5S)-5-methoxy-3,4-bis(pyridin-2-ylmethoxy)oxolan-2-yl]methanol
CID 90773161
(E,2S)-2-[4-(pyridin-2-ylmethoxy)piperidin-1-yl]hept-3-enoic acid
CID 97193866
2-(1-cyclopropylethoxymethyl)pyridine
CID 88973388
(E)-N-(pyridin-2-ylmethoxy)propan-1-imine
CID 88538998
2-ethoxy-1-[7-(pyridin-2-ylmethoxy)-5-thia-2-azaspiro[3.4]octan-2-yl]ethanone
CID 131692577
pyridin-2-ylmethyl hypoiodite
CID 67567753
2-[[(2R,3aR,5R,6S,7S,7aR)-2-methyl-6,7-bis(pyridin-2-ylmethoxy)-5,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-b]pyran-5-yl]methoxymethyl]pyridine
CID 139179480
1-[2-[3-(pyridin-2-ylmethoxy)piperidine-1-carbonyl]phenyl]ethanone
CID 91766002

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethylcyclobutyl)oxymethyl]pyridine?
The IUPAC name of 2-[(3-ethylcyclobutyl)oxymethyl]pyridine (CID 170582773) is 2-[(3-ethylcyclobutyl)oxymethyl]pyridine.
What is the SMILES notation for 2-[(3-ethylcyclobutyl)oxymethyl]pyridine?
The canonical SMILES for 2-[(3-ethylcyclobutyl)oxymethyl]pyridine is CCC1CC(OCc2ccccn2)C1.
What is the InChIKey of 2-[(3-ethylcyclobutyl)oxymethyl]pyridine?
The InChIKey is PAEKYESFKDEXQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-2-10-7-12(8-10)14-9-11-5-3-4-6-13-11/h3-6,10,12H,2,7-9H2,1H3.
What are the key properties of 2-[(3-ethylcyclobutyl)oxymethyl]pyridine?
2-[(3-ethylcyclobutyl)oxymethyl]pyridine has a molecular weight of 191.27 g/mol, XLogP of 2.79, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethylcyclobutyl)oxymethyl]pyridine is sourced from PubChem (CID 170582773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).