4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide

C14H23N3O2 — CID 58155168

IUPAC4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide
SMILESCCN(CC)CCNC(=O)c1ccc(N)c(OC)c1
InChIInChI=1S/C14H23N3O2/c1-4-17(5-2)9-8-16-14(18)11-6-7-12(15)13(10-11)19-3/h6-7,10H,4-5,8-9,15H2,1-3H3,(H,16,18)
InChIKeyBQWBYYRLORMQLP-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.35
Rot. Bonds7

About 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide

4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide (PubChem CID 58155168) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide.

Molecular Properties

Compound Name4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide
PubChem CID58155168
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide
SMILESCCN(CC)CCNC(=O)c1ccc(N)c(OC)c1
InChIInChI=1S/C14H23N3O2/c1-4-17(5-2)9-8-16-14(18)11-6-7-12(15)13(10-11)19-3/h6-7,10H,4-5,8-9,15H2,1-3H3,(H,16,18)
InChIKeyBQWBYYRLORMQLP-UHFFFAOYSA-N
XLogP1.35
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-amino-3-methoxy-N-propylbenzamide
CID 67095444
4-amino-N-[2-(diethylamino)ethyl]-3-hydroxybenzamide
CID 18999797
4-amino-3-methoxy-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide
CID 104782871
4-amino-N-[2-(diethylamino)ethyl]-3-iodobenzamide
CID 112750715
N-[3-(diethylamino)propyl]-3,4-dimethoxybenzamide
CID 3340363
3-acetyl-4-amino-N-[2-(diethylamino)ethyl]benzamide
CID 143395890
methyl 3-[(4-amino-3-methoxybenzoyl)amino]propanoate
CID 104782478
4-amino-N-(3-aminopropyl)-3-methoxybenzamide
CID 89121865
N-[5-(diethylamino)pentyl]-3,4-dimethoxybenzamide
CID 110441376
3-amino-4-chloro-N-[2-(diethylamino)ethyl]benzamide;hydrochloride
CID 117067963
4-amino-3-(cyanomethoxy)-N-[3-(diethylamino)propyl]benzamide
CID 82069925
4-amino-N-[2-(dimethylsulfamoyl)ethyl]-3-methoxybenzamide
CID 106333049

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide?
The IUPAC name of 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide (CID 58155168) is 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide.
What is the SMILES notation for 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide?
The canonical SMILES for 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide is CCN(CC)CCNC(=O)c1ccc(N)c(OC)c1.
What is the InChIKey of 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide?
The InChIKey is BQWBYYRLORMQLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-4-17(5-2)9-8-16-14(18)11-6-7-12(15)13(10-11)19-3/h6-7,10H,4-5,8-9,15H2,1-3H3,(H,16,18).
What are the key properties of 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide?
4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide has a molecular weight of 265.36 g/mol, XLogP of 1.35, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(diethylamino)ethyl]-3-methoxybenzamide is sourced from PubChem (CID 58155168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).