4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide

C16H24N2O — CID 115156272

IUPAC4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide
SMILESCC(CN)CC(=O)N(C)c1ccc2c(c1)CCCC2
InChIInChI=1S/C16H24N2O/c1-12(11-17)9-16(19)18(2)15-8-7-13-5-3-4-6-14(13)10-15/h7-8,10,12H,3-6,9,11,17H2,1-2H3
InChIKeyJLPXGEIZBYCICK-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.51
Rot. Bonds4

About 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide

4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide (PubChem CID 115156272) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide.

Molecular Properties

Compound Name4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide
PubChem CID115156272
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide
SMILESCC(CN)CC(=O)N(C)c1ccc2c(c1)CCCC2
InChIInChI=1S/C16H24N2O/c1-12(11-17)9-16(19)18(2)15-8-7-13-5-3-4-6-14(13)10-15/h7-8,10,12H,3-6,9,11,17H2,1-2H3
InChIKeyJLPXGEIZBYCICK-UHFFFAOYSA-N
XLogP2.51
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide?
The IUPAC name of 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide (CID 115156272) is 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide.
What is the SMILES notation for 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide?
The canonical SMILES for 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide is CC(CN)CC(=O)N(C)c1ccc2c(c1)CCCC2.
What is the InChIKey of 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide?
The InChIKey is JLPXGEIZBYCICK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12(11-17)9-16(19)18(2)15-8-7-13-5-3-4-6-14(13)10-15/h7-8,10,12H,3-6,9,11,17H2,1-2H3.
What are the key properties of 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide?
4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide has a molecular weight of 260.38 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,3-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butanamide is sourced from PubChem (CID 115156272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).