1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C15H25N3 — CID 113489177

IUPAC1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCCc1nc2c(n1C1(CC)CCC1)CCNC2
InChIInChI=1S/C15H25N3/c1-3-6-14-17-12-11-16-10-7-13(12)18(14)15(4-2)8-5-9-15/h16H,3-11H2,1-2H3
InChIKeyUPEWEYDTPWPFLL-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.77
Rot. Bonds4

About 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 113489177) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID113489177
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCCc1nc2c(n1C1(CC)CCC1)CCNC2
InChIInChI=1S/C15H25N3/c1-3-6-14-17-12-11-16-10-7-13(12)18(14)15(4-2)8-5-9-15/h16H,3-11H2,1-2H3
InChIKeyUPEWEYDTPWPFLL-UHFFFAOYSA-N
XLogP2.77
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 113489177) is 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CCCc1nc2c(n1C1(CC)CCC1)CCNC2.
What is the InChIKey of 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is UPEWEYDTPWPFLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-6-14-17-12-11-16-10-7-13(12)18(14)15(4-2)8-5-9-15/h16H,3-11H2,1-2H3.
What are the key properties of 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 247.39 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 113489177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).