4-amino-N-ethyl-2-(2-methylpentoxy)benzamide

C15H24N2O2 — CID 103282874

IUPAC4-amino-N-ethyl-2-(2-methylpentoxy)benzamide
SMILESCCCC(C)COc1cc(N)ccc1C(=O)NCC
InChIInChI=1S/C15H24N2O2/c1-4-6-11(3)10-19-14-9-12(16)7-8-13(14)15(18)17-5-2/h7-9,11H,4-6,10,16H2,1-3H3,(H,17,18)
InChIKeyQNFQRHGSWNUMFU-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.83
Rot. Bonds7

About 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide

4-amino-N-ethyl-2-(2-methylpentoxy)benzamide (PubChem CID 103282874) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide.

Molecular Properties

Compound Name4-amino-N-ethyl-2-(2-methylpentoxy)benzamide
PubChem CID103282874
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-amino-N-ethyl-2-(2-methylpentoxy)benzamide
SMILESCCCC(C)COc1cc(N)ccc1C(=O)NCC
InChIInChI=1S/C15H24N2O2/c1-4-6-11(3)10-19-14-9-12(16)7-8-13(14)15(18)17-5-2/h7-9,11H,4-6,10,16H2,1-3H3,(H,17,18)
InChIKeyQNFQRHGSWNUMFU-UHFFFAOYSA-N
XLogP2.83
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-amino-2-(2-methylpentoxy)benzamide
CID 103284499
4-amino-N-ethyl-2-[2-(2-methoxyethoxy)ethoxy]benzamide
CID 104559956
methyl 4-amino-2-(3-hydroxy-2-methylpropoxy)benzoate
CID 106955001
5-amino-N-ethyl-2-[[(2R)-pentan-2-yl]amino]benzamide
CID 100653834
3-iodo-4-(2-methylpentoxy)aniline
CID 103282911
5-amino-2-ethoxy-N-ethylbenzamide
CID 28689994
4-fluoro-2-(2-methylpentoxy)benzoic acid
CID 107014556
2-amino-5-(2-methylpentoxy)benzamide
CID 103284498
4-amino-2-(2-hydroxypropoxy)benzamide
CID 106955593
4-amino-2-methoxy-N-octan-4-ylbenzamide
CID 106021761
4-amino-3-(2-methylpentoxy)benzamide
CID 103282893
4-amino-2-chloro-N-ethylbenzamide;hydrochloride
CID 47000809

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide?
The IUPAC name of 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide (CID 103282874) is 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide.
What is the SMILES notation for 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide?
The canonical SMILES for 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide is CCCC(C)COc1cc(N)ccc1C(=O)NCC.
What is the InChIKey of 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide?
The InChIKey is QNFQRHGSWNUMFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-6-11(3)10-19-14-9-12(16)7-8-13(14)15(18)17-5-2/h7-9,11H,4-6,10,16H2,1-3H3,(H,17,18).
What are the key properties of 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide?
4-amino-N-ethyl-2-(2-methylpentoxy)benzamide has a molecular weight of 264.37 g/mol, XLogP of 2.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-2-(2-methylpentoxy)benzamide is sourced from PubChem (CID 103282874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).