N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide

C14H23N3O2 — CID 55243321

IUPACN-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide
SMILESCOCC(N)CN(C)C(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C14H23N3O2/c1-16(2)13-7-5-11(6-8-13)14(18)17(3)9-12(15)10-19-4/h5-8,12H,9-10,15H2,1-4H3
InChIKeyFJBJZKBWYAYMNZ-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.80
Rot. Bonds6

About N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide

N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide (PubChem CID 55243321) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide.

Molecular Properties

Compound NameN-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide
PubChem CID55243321
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide
SMILESCOCC(N)CN(C)C(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C14H23N3O2/c1-16(2)13-7-5-11(6-8-13)14(18)17(3)9-12(15)10-19-4/h5-8,12H,9-10,15H2,1-4H3
InChIKeyFJBJZKBWYAYMNZ-UHFFFAOYSA-N
XLogP0.80
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-3-methoxypropyl)-N-methyl-4-propan-2-ylbenzamide
CID 63754011
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)-N,3-dimethylbenzamide
CID 63753658
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,6-dimethylpyridine-2-carboxamide
CID 63753834
N-(2-bromo-3-methoxypropyl)-3-(dimethylamino)-N-methylbenzamide
CID 80670757
N-(2-chloro-3-methoxypropyl)-4-hydroxy-N-methylbenzamide
CID 63398005
N-(2-bromo-3-methoxypropyl)-N,4-dimethylbenzamide
CID 80671004
4-(dimethylamino)-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methylbenzamide
CID 51098419
N-(2-amino-3-methoxypropyl)-N,2-dimethylpropanamide
CID 63754189

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide?
The IUPAC name of N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide (CID 55243321) is N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide.
What is the SMILES notation for N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide?
The canonical SMILES for N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide is COCC(N)CN(C)C(=O)c1ccc(N(C)C)cc1.
What is the InChIKey of N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide?
The InChIKey is FJBJZKBWYAYMNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-16(2)13-7-5-11(6-8-13)14(18)17(3)9-12(15)10-19-4/h5-8,12H,9-10,15H2,1-4H3.
What are the key properties of N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide?
N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide has a molecular weight of 265.36 g/mol, XLogP of 0.80, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-methoxypropyl)-4-(dimethylamino)-N-methylbenzamide is sourced from PubChem (CID 55243321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).