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

C11H14N2O — CID 22882465

IUPACN-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide
SMILESCC(=O)N[C@H]1CNc2ccccc2C1
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)/t10-/m1/s1
InChIKeyHCEIEGOMGWEGOJ-SNVBAGLBSA-N
MW190.25 g/mol
LogP1.16
Rot. Bonds1

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

N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide (PubChem CID 22882465) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide
PubChem CID22882465
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide
SMILESCC(=O)N[C@H]1CNc2ccccc2C1
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)/t10-/m1/s1
InChIKeyHCEIEGOMGWEGOJ-SNVBAGLBSA-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-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide?
The IUPAC name of N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide (CID 22882465) is N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide.
What is the SMILES notation for N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide?
The canonical SMILES for N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide is CC(=O)N[C@H]1CNc2ccccc2C1.
What is the InChIKey of N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide?
The InChIKey is HCEIEGOMGWEGOJ-SNVBAGLBSA-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)/t10-/m1/s1.
What are the key properties of N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide?
N-[(3R)-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-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]acetamide is sourced from PubChem (CID 22882465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).