2-methoxy-5-methyl-N,N-dipropylbenzamide

C15H23NO2 — CID 110761077

IUPAC2-methoxy-5-methyl-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1cc(C)ccc1OC
InChIInChI=1S/C15H23NO2/c1-5-9-16(10-6-2)15(17)13-11-12(3)7-8-14(13)18-4/h7-8,11H,5-6,9-10H2,1-4H3
InChIKeyXRTIKJORLLYBHF-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.27
Rot. Bonds6

About 2-methoxy-5-methyl-N,N-dipropylbenzamide

2-methoxy-5-methyl-N,N-dipropylbenzamide (PubChem CID 110761077) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-methoxy-5-methyl-N,N-dipropylbenzamide.

Molecular Properties

Compound Name2-methoxy-5-methyl-N,N-dipropylbenzamide
PubChem CID110761077
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-methoxy-5-methyl-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1cc(C)ccc1OC
InChIInChI=1S/C15H23NO2/c1-5-9-16(10-6-2)15(17)13-11-12(3)7-8-14(13)18-4/h7-8,11H,5-6,9-10H2,1-4H3
InChIKeyXRTIKJORLLYBHF-UHFFFAOYSA-N
XLogP3.27
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-methoxy-5-methylbenzoyl)-propylamino]acetic acid
CID 61008916
3-(dipropylcarbamoyl)-4-methoxybenzoic acid
CID 129054402
2-amino-5-methyl-N,N-dipropylbenzamide
CID 62073624
N-(2-cyanoethyl)-N-ethyl-2-methoxy-5-methylbenzamide
CID 62503533
5-methyl-2-(methylamino)-N,N-dipropylbenzamide
CID 55082842
2-methoxy-N,5-dimethylbenzohydrazide
CID 116845575
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methoxy-5-methylbenzamide
CID 79667751
N-(2-chloroethyl)-2-methoxy-5-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 107492183
N-(2-cyanopropyl)-N-ethyl-2-methoxy-5-methylbenzamide
CID 62503366
2-amino-N-ethyl-5-methyl-N-propylbenzamide
CID 62511065
N-ethyl-2-fluoro-4-methyl-N-propylbenzamide
CID 79779356
2-bromo-N-[2-(dimethylamino)ethyl]-5-methyl-N-propylbenzamide
CID 81005126

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-methyl-N,N-dipropylbenzamide?
The IUPAC name of 2-methoxy-5-methyl-N,N-dipropylbenzamide (CID 110761077) is 2-methoxy-5-methyl-N,N-dipropylbenzamide.
What is the SMILES notation for 2-methoxy-5-methyl-N,N-dipropylbenzamide?
The canonical SMILES for 2-methoxy-5-methyl-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1cc(C)ccc1OC.
What is the InChIKey of 2-methoxy-5-methyl-N,N-dipropylbenzamide?
The InChIKey is XRTIKJORLLYBHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-5-9-16(10-6-2)15(17)13-11-12(3)7-8-14(13)18-4/h7-8,11H,5-6,9-10H2,1-4H3.
What are the key properties of 2-methoxy-5-methyl-N,N-dipropylbenzamide?
2-methoxy-5-methyl-N,N-dipropylbenzamide has a molecular weight of 249.35 g/mol, XLogP of 3.27, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methyl-N,N-dipropylbenzamide is sourced from PubChem (CID 110761077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).