N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide

C24H27N3O2 — CID 120886692

IUPACN-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
SMILESNCCN(CCc1ccccc1)C(=O)CNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C24H27N3O2/c25-14-16-27(15-13-19-7-2-1-3-8-19)24(29)18-26-23(28)17-21-11-6-10-20-9-4-5-12-22(20)21/h1-12H,13-18,25H2,(H,26,28)
InChIKeyONFYYQRCBYNXKO-UHFFFAOYSA-N
MW389.50 g/mol
LogP2.53
Rot. Bonds9

About N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide

N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide (PubChem CID 120886692) has the molecular formula C24H27N3O2 and a molecular weight of 389.50 g/mol. Its IUPAC name is N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
PubChem CID120886692
Molecular FormulaC24H27N3O2
Molecular Weight389.50 g/mol
Exact Mass389.21
IUPAC NameN-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
SMILESNCCN(CCc1ccccc1)C(=O)CNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C24H27N3O2/c25-14-16-27(15-13-19-7-2-1-3-8-19)24(29)18-26-23(28)17-21-11-6-10-20-9-4-5-12-22(20)21/h1-12H,13-18,25H2,(H,26,28)
InChIKeyONFYYQRCBYNXKO-UHFFFAOYSA-N
XLogP2.53
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide?
The IUPAC name of N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide (CID 120886692) is N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide is NCCN(CCc1ccccc1)C(=O)CNC(=O)Cc1cccc2ccccc12.
What is the InChIKey of N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide?
The InChIKey is ONFYYQRCBYNXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2/c25-14-16-27(15-13-19-7-2-1-3-8-19)24(29)18-26-23(28)17-21-11-6-10-20-9-4-5-12-22(20)21/h1-12H,13-18,25H2,(H,26,28).
What are the key properties of N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide?
N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide has a molecular weight of 389.50 g/mol, XLogP of 2.53, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 120886692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).