N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide

C14H22N2O3 — CID 54987801

IUPACN-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide
SMILESCCN(CC(C)CN)C(=O)c1ccc(OC)cc1O
InChIInChI=1S/C14H22N2O3/c1-4-16(9-10(2)8-15)14(18)12-6-5-11(19-3)7-13(12)17/h5-7,10,17H,4,8-9,15H2,1-3H3
InChIKeyVYCNXYOYYFBSDL-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.46
Rot. Bonds6

About N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide

N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide (PubChem CID 54987801) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide
PubChem CID54987801
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide
SMILESCCN(CC(C)CN)C(=O)c1ccc(OC)cc1O
InChIInChI=1S/C14H22N2O3/c1-4-16(9-10(2)8-15)14(18)12-6-5-11(19-3)7-13(12)17/h5-7,10,17H,4,8-9,15H2,1-3H3
InChIKeyVYCNXYOYYFBSDL-UHFFFAOYSA-N
XLogP1.46
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminoethyl)-N-ethyl-2-hydroxy-4-methoxybenzamide
CID 61351225
N-ethyl-2-hydroxy-5-methoxy-N-(2-methylbutyl)benzamide
CID 79470067
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-2-hydroxy-4-methoxybenzamide
CID 60717216
N-(3-aminopropyl)-2-hydroxy-4-methoxy-N-propylbenzamide
CID 43319215
N-(3-amino-2-methylpropyl)-N-ethyl-2,4-difluorobenzamide
CID 54987846
2-hydroxy-4-methoxy-N-methyl-N-pentan-2-ylbenzamide
CID 43430281
N-(3-amino-2-methylpropyl)-N-ethyl-2-methoxypyridine-3-carboxamide
CID 62874297
N-(4-amino-4-sulfanylidenebutan-2-yl)-2-hydroxy-4-methoxy-N-methylbenzamide
CID 63223234
N-(3-amino-2-methylpropyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide
CID 62829546
2-bromo-N-ethyl-5-methoxy-N-(2-methylpropyl)benzamide
CID 60741091
ethane;2-hydroxy-4-methoxy-N,N-dimethylbenzamide
CID 144990982
N-(2-cyanopropyl)-2-hydroxy-4-methoxy-N-methylbenzamide
CID 47402310

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide (CID 54987801) is N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide is CCN(CC(C)CN)C(=O)c1ccc(OC)cc1O.
What is the InChIKey of N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide?
The InChIKey is VYCNXYOYYFBSDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-4-16(9-10(2)8-15)14(18)12-6-5-11(19-3)7-13(12)17/h5-7,10,17H,4,8-9,15H2,1-3H3.
What are the key properties of N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide?
N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide has a molecular weight of 266.34 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-N-ethyl-2-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 54987801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).