N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine

C14H26N2O — CID 43792646

IUPACN-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
SMILESCOC1CCCCC1NC1CCN2CCCC12
InChIInChI=1S/C14H26N2O/c1-17-14-7-3-2-5-12(14)15-11-8-10-16-9-4-6-13(11)16/h11-15H,2-10H2,1H3
InChIKeyRSWIVEIOWNYDAK-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.77
Rot. Bonds3

About N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine

N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (PubChem CID 43792646) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine.

Molecular Properties

Compound NameN-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
PubChem CID43792646
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
SMILESCOC1CCCCC1NC1CCN2CCCC12
InChIInChI=1S/C14H26N2O/c1-17-14-7-3-2-5-12(14)15-11-8-10-16-9-4-6-13(11)16/h11-15H,2-10H2,1H3
InChIKeyRSWIVEIOWNYDAK-UHFFFAOYSA-N
XLogP1.77
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl (4S)-3-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylamino)-4-methoxypyrrolidine-1-carboxylate
CID 107244781
N-cyclopropyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82852848
trans-(1S,2S)-2-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylamino)cyclopentan-1-ol
CID 102733298
N-(2-pyrrolidin-2-ylcyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 79536664
N-cyclooctyl-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 43694307
[2-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylamino)cyclohexyl]methanol
CID 114178522
N-(8-tricyclo[5.2.1.02,6]decanyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 43752241
2-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylamino)cyclopentane-1-carbonitrile
CID 62741172
N-(1,3-dimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 115709714
N-(2-methoxycyclopentyl)cyclododecanamine
CID 63477774
N-(2-pyrrolidin-2-ylcyclopentyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 79536385
2-[(2-methoxycyclopentyl)amino]cycloheptan-1-ol
CID 62088396

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The IUPAC name of N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (CID 43792646) is N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine.
What is the SMILES notation for N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The canonical SMILES for N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine is COC1CCCCC1NC1CCN2CCCC12.
What is the InChIKey of N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The InChIKey is RSWIVEIOWNYDAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-17-14-7-3-2-5-12(14)15-11-8-10-16-9-4-6-13(11)16/h11-15H,2-10H2,1H3.
What are the key properties of N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine has a molecular weight of 238.37 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxycyclohexyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine is sourced from PubChem (CID 43792646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).