2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine

C17H26N2 — CID 54918181

IUPAC2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine
SMILESCN(C1CCCC1)C1(CN)CCc2ccccc2C1
InChIInChI=1S/C17H26N2/c1-19(16-8-4-5-9-16)17(13-18)11-10-14-6-2-3-7-15(14)12-17/h2-3,6-7,16H,4-5,8-13,18H2,1H3
InChIKeyOQKAEJSZVNOUBZ-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.75
Rot. Bonds3

About 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine

2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine (PubChem CID 54918181) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine
PubChem CID54918181
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine
SMILESCN(C1CCCC1)C1(CN)CCc2ccccc2C1
InChIInChI=1S/C17H26N2/c1-19(16-8-4-5-9-16)17(13-18)11-10-14-6-2-3-7-15(14)12-17/h2-3,6-7,16H,4-5,8-13,18H2,1H3
InChIKeyOQKAEJSZVNOUBZ-UHFFFAOYSA-N
XLogP2.75
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine?
The IUPAC name of 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine (CID 54918181) is 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine.
What is the SMILES notation for 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine?
The canonical SMILES for 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine is CN(C1CCCC1)C1(CN)CCc2ccccc2C1.
What is the InChIKey of 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine?
The InChIKey is OQKAEJSZVNOUBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-19(16-8-4-5-9-16)17(13-18)11-10-14-6-2-3-7-15(14)12-17/h2-3,6-7,16H,4-5,8-13,18H2,1H3.
What are the key properties of 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine?
2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine has a molecular weight of 258.41 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclopentyl-N-methyl-3,4-dihydro-1H-naphthalen-2-amine is sourced from PubChem (CID 54918181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).