N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide

C14H22N2O2 — CID 79668244

IUPACN-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide
SMILESCCN(CC(C)(C)CN)C(=O)c1ccc(O)cc1
InChIInChI=1S/C14H22N2O2/c1-4-16(10-14(2,3)9-15)13(18)11-5-7-12(17)8-6-11/h5-8,17H,4,9-10,15H2,1-3H3
InChIKeyXGKUCKBXBZPMBM-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.84
Rot. Bonds5

About N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide

N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide (PubChem CID 79668244) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide
PubChem CID79668244
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide
SMILESCCN(CC(C)(C)CN)C(=O)c1ccc(O)cc1
InChIInChI=1S/C14H22N2O2/c1-4-16(10-14(2,3)9-15)13(18)11-5-7-12(17)8-6-11/h5-8,17H,4,9-10,15H2,1-3H3
InChIKeyXGKUCKBXBZPMBM-UHFFFAOYSA-N
XLogP1.84
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)-N-ethyl-3-hydroxybenzamide
CID 79667906
N-(3-amino-2,2-dimethylpropyl)-4-chloro-N-ethyl-3-fluorobenzamide
CID 107990619
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-hydroxy-6-oxo-1H-pyridine-4-carboxamide
CID 79667981
N-(3-amino-2,2-dimethylpropyl)-4-hydroxy-3-methyl-N-propylbenzamide
CID 107672177
N-(3-amino-2,2-dimethylpropyl)-4-methoxy-N-propylbenzamide
CID 79667923
4-(aminomethyl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)benzamide
CID 79384782
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-iodobenzamide
CID 79668481
N-(3-amino-2,2-dimethylpropyl)-N-ethylquinoline-2-carboxamide
CID 79663389
N-(3-amino-2,2-dimethylpropyl)-3-chloro-N-ethylthiophene-2-carboxamide
CID 80641264
N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide
CID 79667847
N-ethyl-4-hydroxy-N-tridecylbenzamide
CID 169026642
N-(3-amino-2,2-dimethylpropyl)-2,4-dibromo-N-ethylbenzamide
CID 107940082

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide (CID 79668244) is N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide is CCN(CC(C)(C)CN)C(=O)c1ccc(O)cc1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide?
The InChIKey is XGKUCKBXBZPMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-16(10-14(2,3)9-15)13(18)11-5-7-12(17)8-6-11/h5-8,17H,4,9-10,15H2,1-3H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide?
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide has a molecular weight of 250.34 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide is sourced from PubChem (CID 79668244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).