N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide

C15H21NO — CID 60645733

IUPACN-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
SMILESCC(C)NC(=O)Cc1ccc2c(c1)CCCC2
InChIInChI=1S/C15H21NO/c1-11(2)16-15(17)10-12-7-8-13-5-3-4-6-14(13)9-12/h7-9,11H,3-6,10H2,1-2H3,(H,16,17)
InChIKeyYIIFZIAPABVFDR-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.63
Rot. Bonds3

About N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide

N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide (PubChem CID 60645733) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
PubChem CID60645733
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC NameN-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
SMILESCC(C)NC(=O)Cc1ccc2c(c1)CCCC2
InChIInChI=1S/C15H21NO/c1-11(2)16-15(17)10-12-7-8-13-5-3-4-6-14(13)9-12/h7-9,11H,3-6,10H2,1-2H3,(H,16,17)
InChIKeyYIIFZIAPABVFDR-UHFFFAOYSA-N
XLogP2.63
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide?
The IUPAC name of N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide (CID 60645733) is N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide.
What is the SMILES notation for N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide?
The canonical SMILES for N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide is CC(C)NC(=O)Cc1ccc2c(c1)CCCC2.
What is the InChIKey of N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide?
The InChIKey is YIIFZIAPABVFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-11(2)16-15(17)10-12-7-8-13-5-3-4-6-14(13)9-12/h7-9,11H,3-6,10H2,1-2H3,(H,16,17).
What are the key properties of N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide?
N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide has a molecular weight of 231.34 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide is sourced from PubChem (CID 60645733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).