4-[2-(diethylamino)ethoxy]naphthalen-1-amine

C16H22N2O — CID 55228090

IUPAC4-[2-(diethylamino)ethoxy]naphthalen-1-amine
SMILESCCN(CC)CCOc1ccc(N)c2ccccc12
InChIInChI=1S/C16H22N2O/c1-3-18(4-2)11-12-19-16-10-9-15(17)13-7-5-6-8-14(13)16/h5-10H,3-4,11-12,17H2,1-2H3
InChIKeyHNCBXVOQUVNBAM-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.14
Rot. Bonds6

About 4-[2-(diethylamino)ethoxy]naphthalen-1-amine

4-[2-(diethylamino)ethoxy]naphthalen-1-amine (PubChem CID 55228090) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 4-[2-(diethylamino)ethoxy]naphthalen-1-amine.

Molecular Properties

Compound Name4-[2-(diethylamino)ethoxy]naphthalen-1-amine
PubChem CID55228090
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name4-[2-(diethylamino)ethoxy]naphthalen-1-amine
SMILESCCN(CC)CCOc1ccc(N)c2ccccc12
InChIInChI=1S/C16H22N2O/c1-3-18(4-2)11-12-19-16-10-9-15(17)13-7-5-6-8-14(13)16/h5-10H,3-4,11-12,17H2,1-2H3
InChIKeyHNCBXVOQUVNBAM-UHFFFAOYSA-N
XLogP3.14
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(ethoxymethoxy)naphthalen-1-amine
CID 65364602
4-(3-fluoropropoxy)naphthalen-1-amine
CID 81106275
3-(4-aminonaphthalen-1-yl)oxy-N,N-dimethylpropanamide
CID 63691333
2-[2,3-bis[2-(diethylamino)ethoxy]phenoxy]-N,N-diethylethanamine;iodoethane
CID 22114543
2-[2-(diethylamino)ethoxy]-3,4-difluoroaniline
CID 62533946
5-butoxynaphthalen-1-amine
CID 67167958
6-(4-aminonaphthalen-1-yl)oxyhexan-1-ol
CID 107702017
4-(3,3,3-trifluoropropoxy)naphthalen-1-amine
CID 64552253
2-[2-(aminomethyl)phenoxy]-N,N-diethylethanamine
CID 16787209
4-[2-(diethylamino)ethoxy]quinolin-7-amine
CID 103002290
4-[(4-ethylphenyl)methoxy]naphthalen-1-amine
CID 63690640
4-[2-(3-methoxypropoxy)ethoxy]naphthalen-1-amine
CID 103177326

Frequently Asked Questions

What is the IUPAC name of 4-[2-(diethylamino)ethoxy]naphthalen-1-amine?
The IUPAC name of 4-[2-(diethylamino)ethoxy]naphthalen-1-amine (CID 55228090) is 4-[2-(diethylamino)ethoxy]naphthalen-1-amine.
What is the SMILES notation for 4-[2-(diethylamino)ethoxy]naphthalen-1-amine?
The canonical SMILES for 4-[2-(diethylamino)ethoxy]naphthalen-1-amine is CCN(CC)CCOc1ccc(N)c2ccccc12.
What is the InChIKey of 4-[2-(diethylamino)ethoxy]naphthalen-1-amine?
The InChIKey is HNCBXVOQUVNBAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-3-18(4-2)11-12-19-16-10-9-15(17)13-7-5-6-8-14(13)16/h5-10H,3-4,11-12,17H2,1-2H3.
What are the key properties of 4-[2-(diethylamino)ethoxy]naphthalen-1-amine?
4-[2-(diethylamino)ethoxy]naphthalen-1-amine has a molecular weight of 258.37 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(diethylamino)ethoxy]naphthalen-1-amine is sourced from PubChem (CID 55228090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).