N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide

C14H20N2O4 — CID 146415874

IUPACN-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide
SMILESCCC(=O)Nc1cc(OC)c(NC(=O)CC)cc1OC
InChIInChI=1S/C14H20N2O4/c1-5-13(17)15-9-7-12(20-4)10(8-11(9)19-3)16-14(18)6-2/h7-8H,5-6H2,1-4H3,(H,15,17)(H,16,18)
InChIKeyDYWDOAUTXXQLJO-UHFFFAOYSA-N
MW280.32 g/mol
LogP2.40
Rot. Bonds6

About N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide

N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide (PubChem CID 146415874) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide.

Molecular Properties

Compound NameN-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide
PubChem CID146415874
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC NameN-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide
SMILESCCC(=O)Nc1cc(OC)c(NC(=O)CC)cc1OC
InChIInChI=1S/C14H20N2O4/c1-5-13(17)15-9-7-12(20-4)10(8-11(9)19-3)16-14(18)6-2/h7-8H,5-6H2,1-4H3,(H,15,17)(H,16,18)
InChIKeyDYWDOAUTXXQLJO-UHFFFAOYSA-N
XLogP2.40
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxy-4,5-dimethylphenyl)propanamide
CID 110776816
N-(5-ethyl-2-methoxyphenyl)propanamide
CID 110777230
N-(2-methoxy-4-propan-2-ylphenyl)propanamide
CID 110777573
ethane;N-(6-fluoro-4-methoxy-3-pyridinyl)propanamide
CID 170582954
N-(2-chloro-4-formyl-5-methoxyphenyl)propanamide
CID 87134854
N-[4-[(2-aminoacetyl)amino]-2-methoxyphenyl]propanamide
CID 39184528
2-chloro-N-(4-hydroxy-2,5-dimethoxyphenyl)acetamide
CID 91138680
N-(2,4,5-trimethoxyphenyl)acetamide
CID 54074808
N-[2-chloro-5-methoxy-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide
CID 23513212
methyl N-(2,4,5-trimethoxyphenyl)carbamate
CID 115190416
N-(2,5-dimethoxy-4-methylphenyl)-3-sulfanylpropanamide
CID 115167651
4-(methylamino)-N-(2,4,5-trimethoxyphenyl)butanamide;hydrochloride
CID 119808116

Frequently Asked Questions

What is the IUPAC name of N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide?
The IUPAC name of N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide (CID 146415874) is N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide.
What is the SMILES notation for N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide?
The canonical SMILES for N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide is CCC(=O)Nc1cc(OC)c(NC(=O)CC)cc1OC.
What is the InChIKey of N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide?
The InChIKey is DYWDOAUTXXQLJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-5-13(17)15-9-7-12(20-4)10(8-11(9)19-3)16-14(18)6-2/h7-8H,5-6H2,1-4H3,(H,15,17)(H,16,18).
What are the key properties of N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide?
N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide has a molecular weight of 280.32 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,5-dimethoxy-4-(propanoylamino)phenyl]propanamide is sourced from PubChem (CID 146415874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).