N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine

C16H30N2O — CID 55252371

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine
SMILESCN(CCOC1CCNCC1)CC1CC2CCC1C2
InChIInChI=1S/C16H30N2O/c1-18(8-9-19-16-4-6-17-7-5-16)12-15-11-13-2-3-14(15)10-13/h13-17H,2-12H2,1H3
InChIKeyRTXWYRXYXFAPAB-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.12
Rot. Bonds6

About N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine

N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine (PubChem CID 55252371) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine
PubChem CID55252371
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine
SMILESCN(CCOC1CCNCC1)CC1CC2CCC1C2
InChIInChI=1S/C16H30N2O/c1-18(8-9-19-16-4-6-17-7-5-16)12-15-11-13-2-3-14(15)10-13/h13-17H,2-12H2,1H3
InChIKeyRTXWYRXYXFAPAB-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine with MolForge

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Related Compounds

2-ethoxy-N-methyl-N-(2-piperidin-4-yloxyethyl)ethanamine
CID 81055995
N'-(2-bicyclo[2.2.1]heptanylmethyl)-N-(cyclopropylmethyl)-N'-methylethane-1,2-diamine
CID 55232044
methyl 3-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]propanoate
CID 63684175
N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide
CID 63904900
N-(2-bicyclo[2.2.1]heptanylmethyl)-3,3-diethoxy-N-methylpropan-1-amine
CID 63684185
2-(2-bicyclo[2.2.1]heptanyl)-N-(3-piperidin-4-yloxypropyl)acetamide
CID 63870947
N'-(2-bicyclo[2.2.1]heptanylmethyl)-N-tert-butyl-N'-methylethane-1,2-diamine
CID 63683794
2-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]-1-piperazin-1-ylethanone
CID 55226684
3-[2-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]ethoxy]aniline
CID 63687916
methyl 2-amino-4-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]-2-methylbutanoate
CID 63682513
[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]methyl-trifluoroboranuide
CID 63685558
N-(2-bicyclo[2.2.1]heptanylmethyl)-4-chloro-N-methylbut-2-en-1-amine
CID 77051245

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine (CID 55252371) is N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine is CN(CCOC1CCNCC1)CC1CC2CCC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine?
The InChIKey is RTXWYRXYXFAPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-18(8-9-19-16-4-6-17-7-5-16)12-15-11-13-2-3-14(15)10-13/h13-17H,2-12H2,1H3.
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine?
N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine has a molecular weight of 266.43 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-2-piperidin-4-yloxyethanamine is sourced from PubChem (CID 55252371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).