1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine

C10H17N — CID 14249872

IUPAC1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine
SMILESC1=CN(CC2CCC2)CCC1
InChIInChI=1S/C10H17N/c1-2-7-11(8-3-1)9-10-5-4-6-10/h2,7,10H,1,3-6,8-9H2
InChIKeyUOEFDEBYQLLSMK-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.40
Rot. Bonds2

About 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine

1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine (PubChem CID 14249872) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine
PubChem CID14249872
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine
SMILESC1=CN(CC2CCC2)CCC1
InChIInChI=1S/C10H17N/c1-2-7-11(8-3-1)9-10-5-4-6-10/h2,7,10H,1,3-6,8-9H2
InChIKeyUOEFDEBYQLLSMK-UHFFFAOYSA-N
XLogP2.40
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine?
The IUPAC name of 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine (CID 14249872) is 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine.
What is the SMILES notation for 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine?
The canonical SMILES for 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine is C1=CN(CC2CCC2)CCC1.
What is the InChIKey of 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine?
The InChIKey is UOEFDEBYQLLSMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-2-7-11(8-3-1)9-10-5-4-6-10/h2,7,10H,1,3-6,8-9H2.
What are the key properties of 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine?
1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine has a molecular weight of 151.25 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 14249872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).