N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine

C18H28N2 — CID 29185164

IUPACN,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine
SMILESCN1CCC(N(C)C[C@@H]2CCc3ccccc3C2)CC1
InChIInChI=1S/C18H28N2/c1-19-11-9-18(10-12-19)20(2)14-15-7-8-16-5-3-4-6-17(16)13-15/h3-6,15,18H,7-14H2,1-2H3/t15-/m1/s1
InChIKeyQBUJSXWARQVSTN-OAHLLOKOSA-N
MW272.44 g/mol
LogP2.82
Rot. Bonds3

About N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine

N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine (PubChem CID 29185164) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine.

Molecular Properties

Compound NameN,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine
PubChem CID29185164
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC NameN,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine
SMILESCN1CCC(N(C)C[C@@H]2CCc3ccccc3C2)CC1
InChIInChI=1S/C18H28N2/c1-19-11-9-18(10-12-19)20(2)14-15-7-8-16-5-3-4-6-17(16)13-15/h3-6,15,18H,7-14H2,1-2H3/t15-/m1/s1
InChIKeyQBUJSXWARQVSTN-OAHLLOKOSA-N
XLogP2.82
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidin-4-amine
CID 59369351
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]cyclopropanamine
CID 138723132
N-cyclopropyl-N'-methyl-N'-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)ethane-1,2-diamine
CID 107126634
N-[(4-aminocyclohexyl)methyl]-N,1-dimethylpiperidin-4-amine
CID 60850713
2-propyl-1,2,3,4-tetrahydronaphthalene
CID 13330225
2-(2-methylsulfanylethyl)-1,2,3,4-tetrahydronaphthalene
CID 143252120
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
CID 86313684
4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 115239845
2-(methylsulfanylmethyl)-1,2,3,4-tetrahydronaphthalene
CID 130736237
4-[[methyl-(1-methylpyrrolidin-3-yl)amino]methyl]cyclohexan-1-one
CID 115240121
2-(2-bromoethyl)-1,2,3,4-tetrahydronaphthalene
CID 15752629
3-(1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-ol
CID 67879898

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine?
The IUPAC name of N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine (CID 29185164) is N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine.
What is the SMILES notation for N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine?
The canonical SMILES for N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine is CN1CCC(N(C)C[C@@H]2CCc3ccccc3C2)CC1.
What is the InChIKey of N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine?
The InChIKey is QBUJSXWARQVSTN-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H28N2/c1-19-11-9-18(10-12-19)20(2)14-15-7-8-16-5-3-4-6-17(16)13-15/h3-6,15,18H,7-14H2,1-2H3/t15-/m1/s1.
What are the key properties of N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine?
N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine has a molecular weight of 272.44 g/mol, XLogP of 2.82, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-4-amine is sourced from PubChem (CID 29185164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).