N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide

C17H21NO3 — CID 43143630

IUPACN,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide
SMILESCCN(CC)C(=O)C(C)Oc1ccc2ccc(O)cc2c1
InChIInChI=1S/C17H21NO3/c1-4-18(5-2)17(20)12(3)21-16-9-7-13-6-8-15(19)10-14(13)11-16/h6-12,19H,4-5H2,1-3H3
InChIKeyTUIDCZDPKSCNSC-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.18
Rot. Bonds5

About N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide

N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide (PubChem CID 43143630) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide.

Molecular Properties

Compound NameN,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide
PubChem CID43143630
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC NameN,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide
SMILESCCN(CC)C(=O)C(C)Oc1ccc2ccc(O)cc2c1
InChIInChI=1S/C17H21NO3/c1-4-18(5-2)17(20)12(3)21-16-9-7-13-6-8-15(19)10-14(13)11-16/h6-12,19H,4-5H2,1-3H3
InChIKeyTUIDCZDPKSCNSC-UHFFFAOYSA-N
XLogP3.18
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(7-hydroxynaphthalen-2-yl)oxy-N,N-dimethylpropanamide
CID 43143635
7-butan-2-yloxynaphthalen-2-ol
CID 43143670
2-(4-tert-butylphenoxy)-N,N-diethylpropanamide
CID 19204171
(2R)-2-(3,5-dimethylphenoxy)-N,N-diethylpropanamide
CID 9173438
2-[4-[(1S)-1-aminoethyl]phenoxy]-N,N-diethylpropanamide
CID 63367483
(2S)-2-(3-chlorophenoxy)-N,N-diethylpropanamide
CID 40538344
N,N-diethyl-2-(3-methoxyphenoxy)propanamide
CID 19203980
2-(1,3-benzodioxol-5-yloxy)-N,N-diethylpropanamide
CID 45147826
2-(7-hydroxynaphthalen-2-yl)oxy-N-prop-2-ynylpropanamide
CID 43326439
N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide
CID 166611028
2-(4-cyanophenoxy)-N,N-diethylpropanamide
CID 43083146
N,N-diethyl-2-[3-fluoro-4-(1-hydroxyethyl)phenoxy]propanamide
CID 107719457

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide?
The IUPAC name of N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide (CID 43143630) is N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide.
What is the SMILES notation for N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide?
The canonical SMILES for N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide is CCN(CC)C(=O)C(C)Oc1ccc2ccc(O)cc2c1.
What is the InChIKey of N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide?
The InChIKey is TUIDCZDPKSCNSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3/c1-4-18(5-2)17(20)12(3)21-16-9-7-13-6-8-15(19)10-14(13)11-16/h6-12,19H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide?
N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide has a molecular weight of 287.36 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide is sourced from PubChem (CID 43143630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).