N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide

C13H20N2O2 — CID 63753658

IUPACN-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide
SMILESCOCC(N)CN(C)C(=O)c1cccc(C)c1
InChIInChI=1S/C13H20N2O2/c1-10-5-4-6-11(7-10)13(16)15(2)8-12(14)9-17-3/h4-7,12H,8-9,14H2,1-3H3
InChIKeyARZBNIPIFVWHDK-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.04
Rot. Bonds5

About N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide

N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide (PubChem CID 63753658) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide.

Molecular Properties

Compound NameN-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide
PubChem CID63753658
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide
SMILESCOCC(N)CN(C)C(=O)c1cccc(C)c1
InChIInChI=1S/C13H20N2O2/c1-10-5-4-6-11(7-10)13(16)15(2)8-12(14)9-17-3/h4-7,12H,8-9,14H2,1-3H3
InChIKeyARZBNIPIFVWHDK-UHFFFAOYSA-N
XLogP1.04
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-3-methoxypropyl)-3-fluoro-N-methylbenzamide
CID 55243516
N-(2-amino-3-methoxypropyl)-3-methoxy-N-methylbenzamide
CID 63753839
N-(2-amino-3-methoxypropyl)-N-methylbenzamide
CID 63753648
N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
CID 63754922
N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide
CID 55243321
N-(2-amino-3-methoxypropyl)-N-methyl-4-propan-2-ylbenzamide
CID 63754011
N-(2-amino-3-methoxypropyl)-N,6-dimethylpyridine-2-carboxamide
CID 63753834
N-(2-chloropropyl)-N,3-dimethylbenzamide
CID 63393760
N-[2-(2-aminoethoxy)ethyl]-N,3-dimethylbenzamide
CID 114243695
2-[(2-amino-3-methoxypropyl)-methylamino]-N-(3-methylphenyl)acetamide
CID 55242966
N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide
CID 63754022
N-(2-bromo-3-methoxypropyl)-3-(dimethylamino)-N-methylbenzamide
CID 80670757

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide?
The IUPAC name of N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide (CID 63753658) is N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide.
What is the SMILES notation for N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide?
The canonical SMILES for N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide is COCC(N)CN(C)C(=O)c1cccc(C)c1.
What is the InChIKey of N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide?
The InChIKey is ARZBNIPIFVWHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10-5-4-6-11(7-10)13(16)15(2)8-12(14)9-17-3/h4-7,12H,8-9,14H2,1-3H3.
What are the key properties of N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide?
N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide has a molecular weight of 236.31 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide is sourced from PubChem (CID 63753658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).