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

C16H24N2O2 — CID 107387319

IUPACN-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide
SMILESCC(C)C(C)NC(=O)COC1CNc2ccccc2C1
InChIInChI=1S/C16H24N2O2/c1-11(2)12(3)18-16(19)10-20-14-8-13-6-4-5-7-15(13)17-9-14/h4-7,11-12,14,17H,8-10H2,1-3H3,(H,18,19)
InChIKeyBRRHCFLBRJJASM-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.20
Rot. Bonds5

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

N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide (PubChem CID 107387319) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide
PubChem CID107387319
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide
SMILESCC(C)C(C)NC(=O)COC1CNc2ccccc2C1
InChIInChI=1S/C16H24N2O2/c1-11(2)12(3)18-16(19)10-20-14-8-13-6-4-5-7-15(13)17-9-14/h4-7,11-12,14,17H,8-10H2,1-3H3,(H,18,19)
InChIKeyBRRHCFLBRJJASM-UHFFFAOYSA-N
XLogP2.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide
CID 107387372
N-cyclopropyl-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)propanamide
CID 107387385
3-[2-(2-methoxyethoxy)ethoxy]-1,2,3,4-tetrahydroquinoline
CID 107387379
3-[3-(2-methoxyethoxy)propoxy]-1,2,3,4-tetrahydroquinoline
CID 107387405
N-[(2S)-3-methylbutan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide
CID 30211328
N-(3-methylbutan-2-yl)-2-piperidin-4-yloxyacetamide
CID 61489309
3-methoxy-1,2,3,4-tetrahydroquinoline;hydrochloride
CID 155943544
N-[(2S)-1-hydroxypropan-2-yl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 107219186
3-(4-methylpentyl)-1,2,3,4-tetrahydroquinoline
CID 106781112
octan-2-yl 1,2,3,4-tetrahydroquinoline-3-carboxylate
CID 106902768
2-(2-methylpropoxy)ethyl 1,2,3,4-tetrahydroquinoline-3-carboxylate
CID 106902806
2-(3-aminocyclopentyl)oxy-N-(3-methylbutan-2-yl)acetamide
CID 79466089

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide?
The IUPAC name of N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide (CID 107387319) is N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide.
What is the SMILES notation for N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide?
The canonical SMILES for N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide is CC(C)C(C)NC(=O)COC1CNc2ccccc2C1.
What is the InChIKey of N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide?
The InChIKey is BRRHCFLBRJJASM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11(2)12(3)18-16(19)10-20-14-8-13-6-4-5-7-15(13)17-9-14/h4-7,11-12,14,17H,8-10H2,1-3H3,(H,18,19).
What are the key properties of N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide?
N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-3-yloxy)acetamide is sourced from PubChem (CID 107387319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).