N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline

C15H24N2 — CID 82767922

IUPACN-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline
SMILESCCN(CC1(C)CCCC1N)c1ccccc1
InChIInChI=1S/C15H24N2/c1-3-17(13-8-5-4-6-9-13)12-15(2)11-7-10-14(15)16/h4-6,8-9,14H,3,7,10-12,16H2,1-2H3
InChIKeyFREPQWSHKMSVTH-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.03
Rot. Bonds4

About N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline

N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline (PubChem CID 82767922) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline.

Molecular Properties

Compound NameN-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline
PubChem CID82767922
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline
SMILESCCN(CC1(C)CCCC1N)c1ccccc1
InChIInChI=1S/C15H24N2/c1-3-17(13-8-5-4-6-9-13)12-15(2)11-7-10-14(15)16/h4-6,8-9,14H,3,7,10-12,16H2,1-2H3
InChIKeyFREPQWSHKMSVTH-UHFFFAOYSA-N
XLogP3.03
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
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-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline?
The IUPAC name of N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline (CID 82767922) is N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline.
What is the SMILES notation for N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline?
The canonical SMILES for N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline is CCN(CC1(C)CCCC1N)c1ccccc1.
What is the InChIKey of N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline?
The InChIKey is FREPQWSHKMSVTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-17(13-8-5-4-6-9-13)12-15(2)11-7-10-14(15)16/h4-6,8-9,14H,3,7,10-12,16H2,1-2H3.
What are the key properties of N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline?
N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline has a molecular weight of 232.37 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-amino-1-methylcyclopentyl)methyl]-N-ethylaniline is sourced from PubChem (CID 82767922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).