N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide

C15H20N2O2 — CID 19773270

IUPACN-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
SMILESCCC(=O)NC1CCc2c(cccc2NC(C)=O)C1
InChIInChI=1S/C15H20N2O2/c1-3-15(19)17-12-7-8-13-11(9-12)5-4-6-14(13)16-10(2)18/h4-6,12H,3,7-9H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyNTEYPQGRHFXMEK-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.03
Rot. Bonds3

About N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide

N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide (PubChem CID 19773270) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide.

Molecular Properties

Compound NameN-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
PubChem CID19773270
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
SMILESCCC(=O)NC1CCc2c(cccc2NC(C)=O)C1
InChIInChI=1S/C15H20N2O2/c1-3-15(19)17-12-7-8-13-11(9-12)5-4-6-14(13)16-10(2)18/h4-6,12H,3,7-9H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyNTEYPQGRHFXMEK-UHFFFAOYSA-N
XLogP2.03
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The IUPAC name of N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide (CID 19773270) is N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide.
What is the SMILES notation for N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The canonical SMILES for N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide is CCC(=O)NC1CCc2c(cccc2NC(C)=O)C1.
What is the InChIKey of N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
The InChIKey is NTEYPQGRHFXMEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-15(19)17-12-7-8-13-11(9-12)5-4-6-14(13)16-10(2)18/h4-6,12H,3,7-9H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide?
N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide has a molecular weight of 260.34 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide is sourced from PubChem (CID 19773270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).