spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]

C10H12N2 — CID 139026897

IUPACspiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]
SMILESc1cnc2c(c1)NCC21CCC1
InChIInChI=1S/C10H12N2/c1-3-8-9(11-6-1)10(7-12-8)4-2-5-10/h1,3,6,12H,2,4-5,7H2
InChIKeySXJZIASPWBPRAX-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.93
Rot. Bonds

About spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]

spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane] (PubChem CID 139026897) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane].

Molecular Properties

Compound Namespiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]
PubChem CID139026897
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Namespiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]
SMILESc1cnc2c(c1)NCC21CCC1
InChIInChI=1S/C10H12N2/c1-3-8-9(11-6-1)10(7-12-8)4-2-5-10/h1,3,6,12H,2,4-5,7H2
InChIKeySXJZIASPWBPRAX-UHFFFAOYSA-N
XLogP1.93
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Nornicotine
CID 91462
3-(Pyrrolidin-2-yl)pyridine
CID 412
Tc-2216
CID 10176607
(R)-Nornicotine
CID 93047
Indole, 3-(N-(3-pyridyl)formimidoyl)-
CID 52562
1-phenyl-1H,2H,3H,4H-pyrrolo(1,2-a)pyrazine
CID 2770910
Nornicotyrine
CID 68125
2-(Pyrrolidin-2-yl)pyridine
CID 2771659
1H-Pyrrolo[3,2-b]pyridine-5-methanamine
CID 12096221
5-Benzyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
CID 564587
{1H-pyrrolo[3,2-b]pyridin-2-yl}methanamine
CID 46856478
(-)-Nornicotine
CID 6950513

Frequently Asked Questions

What is the IUPAC name of spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]?
The IUPAC name of spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane] (CID 139026897) is spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane].
What is the SMILES notation for spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]?
The canonical SMILES for spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane] is c1cnc2c(c1)NCC21CCC1.
What is the InChIKey of spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]?
The InChIKey is SXJZIASPWBPRAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-3-8-9(11-6-1)10(7-12-8)4-2-5-10/h1,3,6,12H,2,4-5,7H2.
What are the key properties of spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane]?
spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane] has a molecular weight of 160.22 g/mol, XLogP of 1.93, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,2-dihydropyrrolo[3,2-b]pyridine-3,1'-cyclobutane] is sourced from PubChem (CID 139026897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).