8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine

C14H25N — CID 176778432

IUPAC8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine
SMILESCC(C)(C)C1(C23CCCN2CCC3)CC1
InChIInChI=1S/C14H25N/c1-12(2,3)13(8-9-13)14-6-4-10-15(14)11-5-7-14/h4-11H2,1-3H3
InChIKeyMWCCPXGRGZGIJO-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.44
Rot. Bonds1

About 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine

8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine (PubChem CID 176778432) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine.

Molecular Properties

Compound Name8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine
PubChem CID176778432
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine
SMILESCC(C)(C)C1(C23CCCN2CCC3)CC1
InChIInChI=1S/C14H25N/c1-12(2,3)13(8-9-13)14-6-4-10-15(14)11-5-7-14/h4-11H2,1-3H3
InChIKeyMWCCPXGRGZGIJO-UHFFFAOYSA-N
XLogP3.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-tert-butyl-1,2,3,5,6,7-hexahydropyrrolizine
CID 164798952
1-(2-methyl-1,2,3,5,6,7-hexahydropyrrolizin-8-yl)cyclopropan-1-ol
CID 166533385
1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine
CID 155794244
2-methyl-8-(2-methylpentan-2-yl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 174266527
8-(1-methoxycyclopropyl)-2-prop-2-enyl-1,2,3,5,6,7-hexahydropyrrolizine
CID 172627955
8-fluoro-1,2,3,5,6,7-hexahydropyrrolizine
CID 170194734
2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane
CID 134582203
8-(3,3-dimethylbutyl)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizine
CID 176778512
4-tert-butyl-1,2,2-trimethylbicyclo[2.2.0]hexane
CID 162524647
1-tert-butyl-2,2-dimethylpyrrolidine
CID 58450080
8-ethyl-1,2,3,5,6,7-hexahydropyrrolizine;hydrofluoride
CID 168881533
(2R)-2,8-dimethyl-1,2,3,5,6,7-hexahydropyrrolizine
CID 170704092

Frequently Asked Questions

What is the IUPAC name of 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine?
The IUPAC name of 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine (CID 176778432) is 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine.
What is the SMILES notation for 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine?
The canonical SMILES for 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine is CC(C)(C)C1(C23CCCN2CCC3)CC1.
What is the InChIKey of 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine?
The InChIKey is MWCCPXGRGZGIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-12(2,3)13(8-9-13)14-6-4-10-15(14)11-5-7-14/h4-11H2,1-3H3.
What are the key properties of 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine?
8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine has a molecular weight of 207.36 g/mol, XLogP of 3.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-tert-butylcyclopropyl)-1,2,3,5,6,7-hexahydropyrrolizine is sourced from PubChem (CID 176778432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).