N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide

C16H24N2O2 — CID 107313957

IUPACN-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide
SMILESCC(C)C(C)NC(=O)COc1ccc2c(c1)NCCC2
InChIInChI=1S/C16H24N2O2/c1-11(2)12(3)18-16(19)10-20-14-7-6-13-5-4-8-17-15(13)9-14/h6-7,9,11-12,17H,4-5,8,10H2,1-3H3,(H,18,19)
InChIKeyCSNHWSDYNDAWBK-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.58
Rot. Bonds5

About N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide

N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide (PubChem CID 107313957) 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-7-yloxy)acetamide.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide
PubChem CID107313957
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide
SMILESCC(C)C(C)NC(=O)COc1ccc2c(c1)NCCC2
InChIInChI=1S/C16H24N2O2/c1-11(2)12(3)18-16(19)10-20-14-7-6-13-5-4-8-17-15(13)9-14/h6-7,9,11-12,17H,4-5,8,10H2,1-3H3,(H,18,19)
InChIKeyCSNHWSDYNDAWBK-UHFFFAOYSA-N
XLogP2.58
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 ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-methylbutan-2-yl)acetamide
CID 84602200
N-(3-methylbutan-2-yl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetamide
CID 114940002
N-(2-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide
CID 107313939
N-propan-2-yl-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide
CID 107313910
7-butoxy-1,2,3,4-tetrahydroquinoline
CID 107313953
N-ethyl-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide
CID 107313991
N-cyclopropyl-N-ethyl-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide
CID 107314031
4-(1,2,3,4-tetrahydroquinolin-7-yloxy)butan-1-ol
CID 107313916
N-[(2R)-3-methylbutan-2-yl]-2-naphthalen-2-yloxyacetamide
CID 26218455
N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide
CID 107314025
N,N-dimethyl-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide
CID 107313931
N-tert-butyl-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide
CID 107313908

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide?
The IUPAC name of N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide (CID 107313957) is N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide.
What is the SMILES notation for N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide?
The canonical SMILES for N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide is CC(C)C(C)NC(=O)COc1ccc2c(c1)NCCC2.
What is the InChIKey of N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide?
The InChIKey is CSNHWSDYNDAWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11(2)12(3)18-16(19)10-20-14-7-6-13-5-4-8-17-15(13)9-14/h6-7,9,11-12,17H,4-5,8,10H2,1-3H3,(H,18,19).
What are the key properties of N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide?
N-(3-methylbutan-2-yl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.58, 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-7-yloxy)acetamide is sourced from PubChem (CID 107313957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).