2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine

C10H20N2 — CID 10559044

IUPAC2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine
SMILESCNCCC12CCCN1CCC2
InChIInChI=1S/C10H20N2/c1-11-7-6-10-4-2-8-12(10)9-3-5-10/h11H,2-9H2,1H3
InChIKeyIGXXKLVYQDQTTI-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.22
Rot. Bonds3

About 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine

2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine (PubChem CID 10559044) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine
PubChem CID10559044
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine
SMILESCNCCC12CCCN1CCC2
InChIInChI=1S/C10H20N2/c1-11-7-6-10-4-2-8-12(10)9-3-5-10/h11H,2-9H2,1H3
InChIKeyIGXXKLVYQDQTTI-UHFFFAOYSA-N
XLogP1.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Hexahydro-1H-pyrrolizin-7a-yl)ethanamine
CID 10796977
(Hexahydro-1H-pyrrolizin-7A-YL)methanamine
CID 10654304
2-(hexahydro-1H-pyrrolizin-7a-yl)ethan-1-amine dihydrochloride
CID 53444461
1-Methyl-1,7-diazaspiro[4.4]nonane
CID 52988115
1-Methyl-2-pyrrolidin-3-ylpyrrolidine
CID 82416480
1-(2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylmethanamine
CID 168881308
1-(2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine
CID 172628072
2-Amino-3-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)propanenitrile
CID 10654942
4,4-Dimethyl-5-(3,3,3-trifluoropropyl)-1,2,3,3a,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 66242969
4,4-Dimethyl-5-(2,2,2-trifluoroethyl)-1,2,3,3a,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 66243383
5-(2,2-Difluoroethyl)-4,4-dimethyl-1,2,3,3a,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 66244848
4-ethyl-5-(2-fluoroethyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 80694637

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine?
The IUPAC name of 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine (CID 10559044) is 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine.
What is the SMILES notation for 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine?
The canonical SMILES for 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine is CNCCC12CCCN1CCC2.
What is the InChIKey of 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine?
The InChIKey is IGXXKLVYQDQTTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-11-7-6-10-4-2-8-12(10)9-3-5-10/h11H,2-9H2,1H3.
What are the key properties of 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine?
2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine has a molecular weight of 168.28 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)-N-methylethanamine is sourced from PubChem (CID 10559044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).