2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide

C20H27N3O3 — CID 8925345

IUPAC2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide
SMILESCCCNC(=O)CNC(=O)CN(C)Cc1ccc2cc(OC)ccc2c1
InChIInChI=1S/C20H27N3O3/c1-4-9-21-19(24)12-22-20(25)14-23(2)13-15-5-6-17-11-18(26-3)8-7-16(17)10-15/h5-8,10-11H,4,9,12-14H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyUHZHIKTXNPUWII-UHFFFAOYSA-N
MW357.45 g/mol
LogP1.92
Rot. Bonds9

About 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide

2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide (PubChem CID 8925345) has the molecular formula C20H27N3O3 and a molecular weight of 357.45 g/mol. Its IUPAC name is 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide
PubChem CID8925345
Molecular FormulaC20H27N3O3
Molecular Weight357.45 g/mol
Exact Mass357.21
IUPAC Name2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide
SMILESCCCNC(=O)CNC(=O)CN(C)Cc1ccc2cc(OC)ccc2c1
InChIInChI=1S/C20H27N3O3/c1-4-9-21-19(24)12-22-20(25)14-23(2)13-15-5-6-17-11-18(26-3)8-7-16(17)10-15/h5-8,10-11H,4,9,12-14H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyUHZHIKTXNPUWII-UHFFFAOYSA-N
XLogP1.92
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-fluorophenyl)ethyl]-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 18088830
N-[2-(2-fluorophenyl)ethyl]-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 8925417
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 9053961
N-[2-(4-methoxyphenyl)ethyl]-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8761409
2-[(3-bromo-4-methoxyphenyl)methyl-methylamino]-N-propylacetamide
CID 60670069
2-[[2-[(2-methoxy-5-methylphenyl)methyl-methylamino]acetyl]amino]-N-propylacetamide
CID 8805837
2-[(3-cyano-4-methoxyphenyl)methyl-methylamino]-N-propylacetamide
CID 65344306
N-(5-chloro-2-methylphenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 9053943
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 27081744
2-[(3-chlorophenyl)methyl-methylamino]-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 26512391
N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 9054040
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 8924997

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide?
The IUPAC name of 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide (CID 8925345) is 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide.
What is the SMILES notation for 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide?
The canonical SMILES for 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide is CCCNC(=O)CNC(=O)CN(C)Cc1ccc2cc(OC)ccc2c1.
What is the InChIKey of 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide?
The InChIKey is UHZHIKTXNPUWII-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3/c1-4-9-21-19(24)12-22-20(25)14-23(2)13-15-5-6-17-11-18(26-3)8-7-16(17)10-15/h5-8,10-11H,4,9,12-14H2,1-3H3,(H,21,24)(H,22,25).
What are the key properties of 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide?
2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide has a molecular weight of 357.45 g/mol, XLogP of 1.92, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetyl]amino]-N-propylacetamide is sourced from PubChem (CID 8925345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).