3-methoxy-N,N-dipropylbenzamide

C14H21NO2 — CID 669439

IUPAC3-methoxy-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1cccc(OC)c1
InChIInChI=1S/C14H21NO2/c1-4-9-15(10-5-2)14(16)12-7-6-8-13(11-12)17-3/h6-8,11H,4-5,9-10H2,1-3H3
InChIKeyNQULRHVOEWCHMP-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.96
Rot. Bonds6

About 3-methoxy-N,N-dipropylbenzamide

3-methoxy-N,N-dipropylbenzamide (PubChem CID 669439) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 3-methoxy-N,N-dipropylbenzamide.

Molecular Properties

Compound Name3-methoxy-N,N-dipropylbenzamide
PubChem CID669439
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name3-methoxy-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1cccc(OC)c1
InChIInChI=1S/C14H21NO2/c1-4-9-15(10-5-2)14(16)12-7-6-8-13(11-12)17-3/h6-8,11H,4-5,9-10H2,1-3H3
InChIKeyNQULRHVOEWCHMP-UHFFFAOYSA-N
XLogP2.96
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-bis(2-cyanoethyl)-3-methoxybenzamide
CID 4626859
N-(2-bromoethyl)-N-ethyl-3-methoxybenzamide
CID 80659973
1-N-(3-methoxyphenyl)-4-N,4-N-dipropylbenzene-1,4-dicarboxamide
CID 109049073
methyl 2-[(3-methoxybenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate
CID 62952792
N-ethyl-3-methoxy-N-methylbenzamide
CID 15816607
3-[(4-methoxybenzoyl)amino]-N,N-dipropylbenzamide
CID 26162261
N,N-dihydroxy-3-methoxybenzamide
CID 91426750
3-hydroxy-5-methoxy-N,N-dipropylbenzamide
CID 101268290
3-chloro-N,N-dipropylbenzamide
CID 669182
N-(2-hydroxyethyl)-3-methoxy-N-(2,2,2-trifluoroethyl)benzamide
CID 103857335
ethane;3-ethyl-5-methoxy-N,N-dipropylbenzamide
CID 142843916
propyl 3-(dipropylcarbamoyl)benzoate
CID 90989239

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N,N-dipropylbenzamide?
The IUPAC name of 3-methoxy-N,N-dipropylbenzamide (CID 669439) is 3-methoxy-N,N-dipropylbenzamide.
What is the SMILES notation for 3-methoxy-N,N-dipropylbenzamide?
The canonical SMILES for 3-methoxy-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1cccc(OC)c1.
What is the InChIKey of 3-methoxy-N,N-dipropylbenzamide?
The InChIKey is NQULRHVOEWCHMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-9-15(10-5-2)14(16)12-7-6-8-13(11-12)17-3/h6-8,11H,4-5,9-10H2,1-3H3.
What are the key properties of 3-methoxy-N,N-dipropylbenzamide?
3-methoxy-N,N-dipropylbenzamide has a molecular weight of 235.33 g/mol, XLogP of 2.96, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N,N-dipropylbenzamide is sourced from PubChem (CID 669439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).