N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide

C35H50N2O5 — CID 173391687

IUPACN-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide
SMILESCC(C)(C)C(=O)N(O)CC=Cc1ccc2c(c1)CCCC2.CC(C)(C)C(=O)N(O)CCOc1ccc2c(c1)CCCC2
InChIInChI=1S/C18H25NO2.C17H25NO3/c1-18(2,3)17(20)19(21)12-6-7-14-10-11-15-8-4-5-9-16(15)13-14;1-17(2,3)16(19)18(20)10-11-21-15-9-8-13-6-4-5-7-14(13)12-15/h6-7,10-11,13,21H,4-5,8-9,12H2,1-3H3;8-9,12,20H,4-7,10-11H2,1-3H3
InChIKeyVJYLFJNGQWXJRY-UHFFFAOYSA-N
MW578.79 g/mol
LogP7.05
Rot. Bonds7

About N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide

N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide (PubChem CID 173391687) has the molecular formula C35H50N2O5 and a molecular weight of 578.79 g/mol. Its IUPAC name is N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide.

Molecular Properties

Compound NameN-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide
PubChem CID173391687
Molecular FormulaC35H50N2O5
Molecular Weight578.79 g/mol
Exact Mass578.37
IUPAC NameN-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide
SMILESCC(C)(C)C(=O)N(O)CC=Cc1ccc2c(c1)CCCC2.CC(C)(C)C(=O)N(O)CCOc1ccc2c(c1)CCCC2
InChIInChI=1S/C18H25NO2.C17H25NO3/c1-18(2,3)17(20)19(21)12-6-7-14-10-11-15-8-4-5-9-16(15)13-14;1-17(2,3)16(19)18(20)10-11-21-15-9-8-13-6-4-5-7-14(13)12-15/h6-7,10-11,13,21H,4-5,8-9,12H2,1-3H3;8-9,12,20H,4-7,10-11H2,1-3H3
InChIKeyVJYLFJNGQWXJRY-UHFFFAOYSA-N
XLogP7.05
TPSA90.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500578.79
LogP ≤ 57.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide with MolForge

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Related Compounds

5-(2,3-dihydro-1H-inden-5-yloxy)pentan-2-one
CID 43793468
N-hydroxy-2,2-dimethyl-N-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)propanamide
CID 15670573
2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide
CID 113101539
N,N-diethyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethanamine
CID 10490742
(E)-2-methyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)hex-5-en-2-ol
CID 82478746
(E)-3-(4-methoxyphenyl)-N-methyl-N-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-ylmethyl)prop-2-en-1-amine
CID 118588145
1-tert-butyl-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]urea
CID 112974906
methyl (Z)-3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enoate
CID 92532886
(E)-3-(4-methoxyphenyl)-N-methyl-N-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-ylmethyl)prop-2-en-1-amine;hydrochloride
CID 127044134
1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]pyrrolidin-2-one
CID 82132664
2-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethylamino]acetic acid
CID 94689863
methyl N-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]carbamate
CID 113101472

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide?
The IUPAC name of N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide (CID 173391687) is N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide.
What is the SMILES notation for N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide?
The canonical SMILES for N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide is CC(C)(C)C(=O)N(O)CC=Cc1ccc2c(c1)CCCC2.CC(C)(C)C(=O)N(O)CCOc1ccc2c(c1)CCCC2.
What is the InChIKey of N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide?
The InChIKey is VJYLFJNGQWXJRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO2.C17H25NO3/c1-18(2,3)17(20)19(21)12-6-7-14-10-11-15-8-4-5-9-16(15)13-14;1-17(2,3)16(19)18(20)10-11-21-15-9-8-13-6-4-5-7-14(13)12-15/h6-7,10-11,13,21H,4-5,8-9,12H2,1-3H3;8-9,12,20H,4-7,10-11H2,1-3H3.
What are the key properties of N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide?
N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide has a molecular weight of 578.79 g/mol, XLogP of 7.05, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide;N-hydroxy-2,2-dimethyl-N-[3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enyl]propanamide is sourced from PubChem (CID 173391687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).