N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide

C16H24N2O2 — CID 60681149

IUPACN-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
SMILESCOCCCNC(=O)CNc1cccc2c1CCCC2
InChIInChI=1S/C16H24N2O2/c1-20-11-5-10-17-16(19)12-18-15-9-4-7-13-6-2-3-8-14(13)15/h4,7,9,18H,2-3,5-6,8,10-12H2,1H3,(H,17,19)
InChIKeyZGLIWVQIEZRRNL-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.13
Rot. Bonds7

About N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide

N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide (PubChem CID 60681149) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
PubChem CID60681149
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
SMILESCOCCCNC(=O)CNc1cccc2c1CCCC2
InChIInChI=1S/C16H24N2O2/c1-20-11-5-10-17-16(19)12-18-15-9-4-7-13-6-2-3-8-14(13)15/h4,7,9,18H,2-3,5-6,8,10-12H2,1H3,(H,17,19)
InChIKeyZGLIWVQIEZRRNL-UHFFFAOYSA-N
XLogP2.13
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

methyl 2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetate
CID 43179666
2-(2-bromo-3-chloroanilino)-N-(3-methoxypropyl)acetamide
CID 103478891
2-(2,5-dimethylanilino)-N-(3-methoxypropyl)acetamide
CID 39353588
N-(tert-butylcarbamoyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 26509429
2-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 17386781
N-(5-fluoro-2-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 37478676
N-(2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 46797713
N-(2,4-dimethoxyphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 42996619
ethyl 2-[[2-(3-methoxypropylamino)-2-oxoethyl]amino]benzoate
CID 108994192
N-(3-methoxypropyl)-2-[2-(2-methylpropoxy)anilino]acetamide
CID 54824114
tert-butyl N-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)ethyl]carbamate
CID 60596283
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 46797716

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The IUPAC name of N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide (CID 60681149) is N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The canonical SMILES for N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide is COCCCNC(=O)CNc1cccc2c1CCCC2.
What is the InChIKey of N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
The InChIKey is ZGLIWVQIEZRRNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-20-11-5-10-17-16(19)12-18-15-9-4-7-13-6-2-3-8-14(13)15/h4,7,9,18H,2-3,5-6,8,10-12H2,1H3,(H,17,19).
What are the key properties of N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide?
N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.13, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide is sourced from PubChem (CID 60681149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).