N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide

C23H34N2O3 — CID 66933701

IUPACN-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide
SMILESCCN(CC)CCN(CCO)C(=O)CCOCCc1cccc2ccccc12
InChIInChI=1S/C23H34N2O3/c1-3-24(4-2)14-15-25(16-17-26)23(27)13-19-28-18-12-21-10-7-9-20-8-5-6-11-22(20)21/h5-11,26H,3-4,12-19H2,1-2H3
InChIKeyUHEWDJQKVSOPCI-UHFFFAOYSA-N
MW386.54 g/mol
LogP2.95
Rot. Bonds13

About N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide

N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide (PubChem CID 66933701) has the molecular formula C23H34N2O3 and a molecular weight of 386.54 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide
PubChem CID66933701
Molecular FormulaC23H34N2O3
Molecular Weight386.54 g/mol
Exact Mass386.26
IUPAC NameN-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide
SMILESCCN(CC)CCN(CCO)C(=O)CCOCCc1cccc2ccccc12
InChIInChI=1S/C23H34N2O3/c1-3-24(4-2)14-15-25(16-17-26)23(27)13-19-28-18-12-21-10-7-9-20-8-5-6-11-22(20)21/h5-11,26H,3-4,12-19H2,1-2H3
InChIKeyUHEWDJQKVSOPCI-UHFFFAOYSA-N
XLogP2.95
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.54
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide;oxalyl dichloride
CID 87673764
N,N-bis(2-hydroxyethyl)-2-naphthalen-1-ylacetamide
CID 60653051
N-[2-(diethylamino)ethyl]-N-[2-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-(2-naphthalen-1-ylethoxy)propanamide;2-hydroxypropanoic acid
CID 25031187
N-[2-(diethylamino)ethyl]-N-[2-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-(2-naphthalen-1-ylethoxy)propanamide;furan-3-carboxylic acid
CID 25155653
N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride
CID 22666549
3-[2-(3-chlorophenyl)ethoxy]-N-[2-(diethylamino)ethyl]-N-(2-oxoethyl)propanamide
CID 59224576
4-ethoxy-1-naphthalen-1-ylbutan-2-one
CID 61054445
N,N-diethyl-16-naphthalen-1-ylhexadecan-1-amine
CID 70613686
ethane;2-naphthalen-1-ylethanol
CID 145119048
2-naphthalen-1-ylethanol;2-naphthalen-1-ylethyl acetate
CID 158105320
N,N-diethyl-16-naphthalen-1-ylhexadecan-1-amine;hydrochloride
CID 174059357
2-[2-methoxyethyl(naphthalen-1-ylmethyl)amino]ethanol
CID 111103161

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide (CID 66933701) is N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide is CCN(CC)CCN(CCO)C(=O)CCOCCc1cccc2ccccc12.
What is the InChIKey of N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide?
The InChIKey is UHEWDJQKVSOPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N2O3/c1-3-24(4-2)14-15-25(16-17-26)23(27)13-19-28-18-12-21-10-7-9-20-8-5-6-11-22(20)21/h5-11,26H,3-4,12-19H2,1-2H3.
What are the key properties of N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide?
N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide has a molecular weight of 386.54 g/mol, XLogP of 2.95, 13 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide is sourced from PubChem (CID 66933701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).