N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine

C19H30N2 — CID 79413441

IUPACN-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine
SMILESCCNC1CCN(C2CCc3ccccc3C2)C(C)C1C
InChIInChI=1S/C19H30N2/c1-4-20-19-11-12-21(15(3)14(19)2)18-10-9-16-7-5-6-8-17(16)13-18/h5-8,14-15,18-20H,4,9-13H2,1-3H3
InChIKeyMWRFQYVLFNBHGM-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.25
Rot. Bonds3

About N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine

N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine (PubChem CID 79413441) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine
PubChem CID79413441
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC NameN-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine
SMILESCCNC1CCN(C2CCc3ccccc3C2)C(C)C1C
InChIInChI=1S/C19H30N2/c1-4-20-19-11-12-21(15(3)14(19)2)18-10-9-16-7-5-6-8-17(16)13-18/h5-8,14-15,18-20H,4,9-13H2,1-3H3
InChIKeyMWRFQYVLFNBHGM-UHFFFAOYSA-N
XLogP3.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine?
The IUPAC name of N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine (CID 79413441) is N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine?
The canonical SMILES for N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine is CCNC1CCN(C2CCc3ccccc3C2)C(C)C1C.
What is the InChIKey of N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine?
The InChIKey is MWRFQYVLFNBHGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-4-20-19-11-12-21(15(3)14(19)2)18-10-9-16-7-5-6-8-17(16)13-18/h5-8,14-15,18-20H,4,9-13H2,1-3H3.
What are the key properties of N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine?
N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine has a molecular weight of 286.46 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,3-dimethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine is sourced from PubChem (CID 79413441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).