N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine

C19H30N2 — CID 63854126

IUPACN-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine
SMILESCNC(C)C1CCN(CC2CCCc3ccccc32)CC1
InChIInChI=1S/C19H30N2/c1-15(20-2)16-10-12-21(13-11-16)14-18-8-5-7-17-6-3-4-9-19(17)18/h3-4,6,9,15-16,18,20H,5,7-8,10-14H2,1-2H3
InChIKeyKLYNPICYTNYSMS-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.43
Rot. Bonds4

About N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine

N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine (PubChem CID 63854126) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine
PubChem CID63854126
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC NameN-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine
SMILESCNC(C)C1CCN(CC2CCCc3ccccc32)CC1
InChIInChI=1S/C19H30N2/c1-15(20-2)16-10-12-21(13-11-16)14-18-8-5-7-17-6-3-4-9-19(17)18/h3-4,6,9,15-16,18,20H,5,7-8,10-14H2,1-2H3
InChIKeyKLYNPICYTNYSMS-UHFFFAOYSA-N
XLogP3.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]methyl]ethanamine
CID 63772800
[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]methanol
CID 55242278
1-(2-bromoethyl)-4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperazine
CID 80678906
(1R)-1-cyclohexyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)ethanamine
CID 81384440
3-chloro-1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)pyrrolidine
CID 63771318
1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-1,4-diazepane
CID 63772764
1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 54453127
1-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-4-(1-chloroethyl)piperidine
CID 106838163
3-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperazine
CID 64833584
N-[1-(4-methylpiperazin-1-yl)propan-2-yl]-1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)pyrrolidine-3-carboxamide
CID 75455738
N,3,3-trimethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-2-amine
CID 115812436
N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-2-yl]methanamine
CID 63771773

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine?
The IUPAC name of N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine (CID 63854126) is N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine.
What is the SMILES notation for N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine?
The canonical SMILES for N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine is CNC(C)C1CCN(CC2CCCc3ccccc32)CC1.
What is the InChIKey of N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine?
The InChIKey is KLYNPICYTNYSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-15(20-2)16-10-12-21(13-11-16)14-18-8-5-7-17-6-3-4-9-19(17)18/h3-4,6,9,15-16,18,20H,5,7-8,10-14H2,1-2H3.
What are the key properties of N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine?
N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine has a molecular weight of 286.46 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]ethanamine is sourced from PubChem (CID 63854126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).