N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide

C11H14N2O — CID 19697545

IUPACN-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide
SMILESCC(=O)NC1CNc2ccccc2C1
InChIInChI=1S/C11H14N2O/c1-8(14)13-10-6-9-4-2-3-5-11(9)12-7-10/h2-5,10,12H,6-7H2,1H3,(H,13,14)
InChIKeyHCEIEGOMGWEGOJ-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.16
Rot. Bonds1

About N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide

N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide (PubChem CID 19697545) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide
PubChem CID19697545
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide
SMILESCC(=O)NC1CNc2ccccc2C1
InChIInChI=1S/C11H14N2O/c1-8(14)13-10-6-9-4-2-3-5-11(9)12-7-10/h2-5,10,12H,6-7H2,1H3,(H,13,14)
InChIKeyHCEIEGOMGWEGOJ-UHFFFAOYSA-N
XLogP1.16
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide?
The IUPAC name of N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide (CID 19697545) is N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide?
The canonical SMILES for N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide is CC(=O)NC1CNc2ccccc2C1.
What is the InChIKey of N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide?
The InChIKey is HCEIEGOMGWEGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-8(14)13-10-6-9-4-2-3-5-11(9)12-7-10/h2-5,10,12H,6-7H2,1H3,(H,13,14).
What are the key properties of N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide?
N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide has a molecular weight of 190.25 g/mol, XLogP of 1.16, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydroquinolin-3-yl)acetamide is sourced from PubChem (CID 19697545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).