5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide

C14H20N2O3 — CID 15027317

IUPAC5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide
SMILESCCCNC(=O)c1cc(O)cc(C(=O)NCCC)c1
InChIInChI=1S/C14H20N2O3/c1-3-5-15-13(18)10-7-11(9-12(17)8-10)14(19)16-6-4-2/h7-9,17H,3-6H2,1-2H3,(H,15,18)(H,16,19)
InChIKeyZJICJNYPPMBUCH-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.67
Rot. Bonds6

About 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide

5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide (PubChem CID 15027317) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide.

Molecular Properties

Compound Name5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide
PubChem CID15027317
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide
SMILESCCCNC(=O)c1cc(O)cc(C(=O)NCCC)c1
InChIInChI=1S/C14H20N2O3/c1-3-5-15-13(18)10-7-11(9-12(17)8-10)14(19)16-6-4-2/h7-9,17H,3-6H2,1-2H3,(H,15,18)(H,16,19)
InChIKeyZJICJNYPPMBUCH-UHFFFAOYSA-N
XLogP1.67
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-3,5-dihydroxybenzamide
CID 91715801
1-N,3-N-bis(2-hydroxyethyl)-5-N-propylbenzene-1,3,5-tricarboxamide
CID 58035795
3,5-diamino-N-propylbenzamide
CID 20701636
3-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 47231705
3,5-dichloro-N-propylbenzamide
CID 2767298
3,5-dihydroxy-N-[2-(pentanoylamino)ethyl]benzamide
CID 108542562
5-acetyl-3-N-propylbenzene-1,3-dicarboxamide
CID 126540698
N-[2-[(3,5-dihydroxybenzoyl)amino]ethyl]-3,4,5-trihydroxybenzamide
CID 108540173
N-[2-(dimethylcarbamoylamino)ethyl]-3,5-dihydroxybenzamide
CID 108575005
1-N-methyl-3-N-propylbenzene-1,3-dicarboxamide
CID 69320035
N-butyl-3-hydroxy-5-nitrobenzamide
CID 125116137
N-(3-chloropropyl)-3,5-dihydroxybenzamide
CID 107705954

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide?
The IUPAC name of 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide (CID 15027317) is 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide.
What is the SMILES notation for 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide?
The canonical SMILES for 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide is CCCNC(=O)c1cc(O)cc(C(=O)NCCC)c1.
What is the InChIKey of 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide?
The InChIKey is ZJICJNYPPMBUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-5-15-13(18)10-7-11(9-12(17)8-10)14(19)16-6-4-2/h7-9,17H,3-6H2,1-2H3,(H,15,18)(H,16,19).
What are the key properties of 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide?
5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.67, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-N,3-N-dipropylbenzene-1,3-dicarboxamide is sourced from PubChem (CID 15027317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).