N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide

C14H19NO — CID 10353304

IUPACN-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide
SMILESCCCC(=O)NC1CCc2ccccc2C1
InChIInChI=1S/C14H19NO/c1-2-5-14(16)15-13-9-8-11-6-3-4-7-12(11)10-13/h3-4,6-7,13H,2,5,8-10H2,1H3,(H,15,16)
InChIKeyMUHGJKOMDOLETG-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.46
Rot. Bonds3

About N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide

N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide (PubChem CID 10353304) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide
PubChem CID10353304
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC NameN-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide
SMILESCCCC(=O)NC1CCc2ccccc2C1
InChIInChI=1S/C14H19NO/c1-2-5-14(16)15-13-9-8-11-6-3-4-7-12(11)10-13/h3-4,6-7,13H,2,5,8-10H2,1H3,(H,15,16)
InChIKeyMUHGJKOMDOLETG-UHFFFAOYSA-N
XLogP2.46
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide?
The IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide (CID 10353304) is N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide?
The canonical SMILES for N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide is CCCC(=O)NC1CCc2ccccc2C1.
What is the InChIKey of N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide?
The InChIKey is MUHGJKOMDOLETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-2-5-14(16)15-13-9-8-11-6-3-4-7-12(11)10-13/h3-4,6-7,13H,2,5,8-10H2,1H3,(H,15,16).
What are the key properties of N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide?
N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide has a molecular weight of 217.31 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide is sourced from PubChem (CID 10353304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).