N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide

C18H24N2O2 — CID 119641906

IUPACN-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide
SMILESCCC(N)(CC)CNC(=O)COc1cccc2ccccc12
InChIInChI=1S/C18H24N2O2/c1-3-18(19,4-2)13-20-17(21)12-22-16-11-7-9-14-8-5-6-10-15(14)16/h5-11H,3-4,12-13,19H2,1-2H3,(H,20,21)
InChIKeyYWAJVDNDSPWYHO-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.85
Rot. Bonds7

About N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide

N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide (PubChem CID 119641906) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide
PubChem CID119641906
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide
SMILESCCC(N)(CC)CNC(=O)COc1cccc2ccccc12
InChIInChI=1S/C18H24N2O2/c1-3-18(19,4-2)13-20-17(21)12-22-16-11-7-9-14-8-5-6-10-15(14)16/h5-11H,3-4,12-13,19H2,1-2H3,(H,20,21)
InChIKeyYWAJVDNDSPWYHO-UHFFFAOYSA-N
XLogP2.85
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide (CID 119641906) is N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide is CCC(N)(CC)CNC(=O)COc1cccc2ccccc12.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide?
The InChIKey is YWAJVDNDSPWYHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-3-18(19,4-2)13-20-17(21)12-22-16-11-7-9-14-8-5-6-10-15(14)16/h5-11H,3-4,12-13,19H2,1-2H3,(H,20,21).
What are the key properties of N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide?
N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide has a molecular weight of 300.40 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-2-naphthalen-1-yloxyacetamide is sourced from PubChem (CID 119641906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).