N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine

C16H23N — CID 63277998

IUPACN-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCC1CCCC1NC1CCc2ccccc2C1
InChIInChI=1S/C16H23N/c1-12-5-4-8-16(12)17-15-10-9-13-6-2-3-7-14(13)11-15/h2-3,6-7,12,15-17H,4-5,8-11H2,1H3
InChIKeyQAJPJEJVDIXIGA-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.32
Rot. Bonds2

About N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine

N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 63277998) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID63277998
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC NameN-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCC1CCCC1NC1CCc2ccccc2C1
InChIInChI=1S/C16H23N/c1-12-5-4-8-16(12)17-15-10-9-13-6-2-3-7-14(13)11-15/h2-3,6-7,12,15-17H,4-5,8-11H2,1H3
InChIKeyQAJPJEJVDIXIGA-UHFFFAOYSA-N
XLogP3.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine (CID 63277998) is N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine is CC1CCCC1NC1CCc2ccccc2C1.
What is the InChIKey of N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is QAJPJEJVDIXIGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-12-5-4-8-16(12)17-15-10-9-13-6-2-3-7-14(13)11-15/h2-3,6-7,12,15-17H,4-5,8-11H2,1H3.
What are the key properties of N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 229.37 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclopentyl)-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 63277998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).