N-methyl-N-naphthalen-1-ylpiperidin-4-amine

C16H20N2 — CID 57088493

IUPACN-methyl-N-naphthalen-1-ylpiperidin-4-amine
SMILESCN(c1cccc2ccccc12)C1CCNCC1
InChIInChI=1S/C16H20N2/c1-18(14-9-11-17-12-10-14)16-8-4-6-13-5-2-3-7-15(13)16/h2-8,14,17H,9-12H2,1H3
InChIKeyHEGOFYWIBIJCTQ-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.03
Rot. Bonds2

About N-methyl-N-naphthalen-1-ylpiperidin-4-amine

N-methyl-N-naphthalen-1-ylpiperidin-4-amine (PubChem CID 57088493) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-methyl-N-naphthalen-1-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-methyl-N-naphthalen-1-ylpiperidin-4-amine
PubChem CID57088493
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-methyl-N-naphthalen-1-ylpiperidin-4-amine
SMILESCN(c1cccc2ccccc12)C1CCNCC1
InChIInChI=1S/C16H20N2/c1-18(14-9-11-17-12-10-14)16-8-4-6-13-5-2-3-7-15(13)16/h2-8,14,17H,9-12H2,1H3
InChIKeyHEGOFYWIBIJCTQ-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-naphthalen-1-ylpiperidin-4-amine?
The IUPAC name of N-methyl-N-naphthalen-1-ylpiperidin-4-amine (CID 57088493) is N-methyl-N-naphthalen-1-ylpiperidin-4-amine.
What is the SMILES notation for N-methyl-N-naphthalen-1-ylpiperidin-4-amine?
The canonical SMILES for N-methyl-N-naphthalen-1-ylpiperidin-4-amine is CN(c1cccc2ccccc12)C1CCNCC1.
What is the InChIKey of N-methyl-N-naphthalen-1-ylpiperidin-4-amine?
The InChIKey is HEGOFYWIBIJCTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-18(14-9-11-17-12-10-14)16-8-4-6-13-5-2-3-7-15(13)16/h2-8,14,17H,9-12H2,1H3.
What are the key properties of N-methyl-N-naphthalen-1-ylpiperidin-4-amine?
N-methyl-N-naphthalen-1-ylpiperidin-4-amine has a molecular weight of 240.35 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-naphthalen-1-ylpiperidin-4-amine is sourced from PubChem (CID 57088493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).