N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide

C17H21NO2 — CID 19602319

IUPACN-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide
SMILESCCNC(=O)c1c(OC(C)(C)C)ccc2ccccc12
InChIInChI=1S/C17H21NO2/c1-5-18-16(19)15-13-9-7-6-8-12(13)10-11-14(15)20-17(2,3)4/h6-11H,5H2,1-4H3,(H,18,19)
InChIKeyKUKOLUDBYODOGQ-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.77
Rot. Bonds3

About N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide

N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide (PubChem CID 19602319) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide
PubChem CID19602319
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC NameN-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide
SMILESCCNC(=O)c1c(OC(C)(C)C)ccc2ccccc12
InChIInChI=1S/C17H21NO2/c1-5-18-16(19)15-13-9-7-6-8-12(13)10-11-14(15)20-17(2,3)4/h6-11H,5H2,1-4H3,(H,18,19)
InChIKeyKUKOLUDBYODOGQ-UHFFFAOYSA-N
XLogP3.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-bis[(2-methylpropan-2-yl)oxy]naphthalene
CID 18761970
[1-[2-[(2-methylpropan-2-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxyphosphane
CID 71241204
2-[4-[1-[(2-methoxynaphthalene-1-carbonyl)amino]propan-2-yl]phenoxy]-2-methylpropanoic acid
CID 71161540
2-methoxynaphthalene-1-carbonyl chloride
CID 3016662
2-ethoxy-N-(3-hydroxy-3-phenylpropyl)naphthalene-1-carboxamide
CID 90499582
ethane;N-ethylnaphthalene-1-carboxamide;propane
CID 144944456
N-[(2S)-butan-2-yl]-2-ethoxynaphthalene-1-carboxamide
CID 9497386
2-ethoxy-N-[(2R)-2-ethylhexyl]naphthalene-1-carboxamide
CID 9497344
2-ethoxy-N-[2-[4-[2-hydroxy-3-[(2-methylpropan-2-yl)oxy]propyl]piperazin-1-yl]ethyl]naphthalene-1-carboxamide
CID 91812891
2-methoxy-N,N-dimethylnaphthalene-1-carboxamide
CID 23279235
2-ethoxy-N-[3-(2-methoxyphenyl)prop-2-ynyl]naphthalene-1-carboxamide
CID 90549244
2-chloro-2,2-difluoro-1-(2-methoxynaphthalen-1-yl)ethanone
CID 146007256

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide?
The IUPAC name of N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide (CID 19602319) is N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide.
What is the SMILES notation for N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide?
The canonical SMILES for N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide is CCNC(=O)c1c(OC(C)(C)C)ccc2ccccc12.
What is the InChIKey of N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide?
The InChIKey is KUKOLUDBYODOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-5-18-16(19)15-13-9-7-6-8-12(13)10-11-14(15)20-17(2,3)4/h6-11H,5H2,1-4H3,(H,18,19).
What are the key properties of N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide?
N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide has a molecular weight of 271.36 g/mol, XLogP of 3.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide is sourced from PubChem (CID 19602319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).