1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine

C18H25N3 — CID 71142186

IUPAC1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine
SMILESCNc1ccc2ccccc2c1N1CCCC(CCN)C1
InChIInChI=1S/C18H25N3/c1-20-17-9-8-15-6-2-3-7-16(15)18(17)21-12-4-5-14(13-21)10-11-19/h2-3,6-9,14,20H,4-5,10-13,19H2,1H3
InChIKeyDEPXCZDOGLSSAU-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.45
Rot. Bonds4

About 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine

1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine (PubChem CID 71142186) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine.

Molecular Properties

Compound Name1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine
PubChem CID71142186
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine
SMILESCNc1ccc2ccccc2c1N1CCCC(CCN)C1
InChIInChI=1S/C18H25N3/c1-20-17-9-8-15-6-2-3-7-16(15)18(17)21-12-4-5-14(13-21)10-11-19/h2-3,6-9,14,20H,4-5,10-13,19H2,1H3
InChIKeyDEPXCZDOGLSSAU-UHFFFAOYSA-N
XLogP3.45
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-(2-aminoethyl)piperidin-1-yl]-1-methylquinolin-2-one
CID 81244041
2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine
CID 117002698
2-[1-(4-chlorophenyl)piperidin-3-yl]ethanamine
CID 83824658
2-[1-(4-fluorophenyl)piperidin-3-yl]ethanamine
CID 83822888
2-[1-(naphthalen-2-ylmethyl)piperidin-3-yl]ethanamine;hydrochloride
CID 120728409
2-[1-(3-chlorophenyl)piperidin-3-yl]ethanamine
CID 83824657
3-(2-aminoethyl)-N-naphthalen-1-ylpyrrolidine-1-carboxamide
CID 114802238
2-[1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]ethanamine
CID 63761850
2-[1-(3-methylpyrazin-2-yl)piperidin-3-yl]ethanamine
CID 83065103
2-[1-[3-(aminomethyl)quinolin-4-yl]piperidin-3-yl]ethanol
CID 107227097
2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-3-yl]ethanamine
CID 65168736
[3-(2-aminoethyl)piperidin-1-yl]-(3-hydroxyphenyl)methanone
CID 63766901

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine?
The IUPAC name of 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine (CID 71142186) is 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine.
What is the SMILES notation for 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine?
The canonical SMILES for 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine is CNc1ccc2ccccc2c1N1CCCC(CCN)C1.
What is the InChIKey of 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine?
The InChIKey is DEPXCZDOGLSSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-20-17-9-8-15-6-2-3-7-16(15)18(17)21-12-4-5-14(13-21)10-11-19/h2-3,6-9,14,20H,4-5,10-13,19H2,1H3.
What are the key properties of 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine?
1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine has a molecular weight of 283.42 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-aminoethyl)piperidin-1-yl]-N-methylnaphthalen-2-amine is sourced from PubChem (CID 71142186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).