2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide

C14H20N2O4 — CID 61149422

IUPAC2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide
SMILESCCCNC(=O)CCNC(=O)c1cccc(OC)c1O
InChIInChI=1S/C14H20N2O4/c1-3-8-15-12(17)7-9-16-14(19)10-5-4-6-11(20-2)13(10)18/h4-6,18H,3,7-9H2,1-2H3,(H,15,17)(H,16,19)
InChIKeyGFPRJCIHVYCIPA-UHFFFAOYSA-N
MW280.32 g/mol
LogP1.05
Rot. Bonds7

About 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide

2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide (PubChem CID 61149422) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide
PubChem CID61149422
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide
SMILESCCCNC(=O)CCNC(=O)c1cccc(OC)c1O
InChIInChI=1S/C14H20N2O4/c1-3-8-15-12(17)7-9-16-14(19)10-5-4-6-11(20-2)13(10)18/h4-6,18H,3,7-9H2,1-2H3,(H,15,17)(H,16,19)
InChIKeyGFPRJCIHVYCIPA-UHFFFAOYSA-N
XLogP1.05
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-3-methoxy-N-[3-oxo-3-(propan-2-ylamino)propyl]benzamide
CID 115670745
N-[2-(ethylamino)ethyl]-2-hydroxy-3-methoxybenzamide
CID 62656877
2-hydroxy-6-methoxy-N-propylbenzamide
CID 84579124
2-[(2-hydroxy-3-methoxybenzoyl)amino]ethyl carbamate
CID 83203383
2-hydroxy-N-[2-(methanesulfonamido)ethyl]-3-methoxybenzamide
CID 43420679
N-[3-oxo-3-(propylamino)propyl]-2-(propylamino)benzamide
CID 62178281
2-amino-N-[3-oxo-3-(propylamino)propyl]benzamide;hydrochloride
CID 119944917
N-(2-ethylbutyl)-2-hydroxy-3-methoxybenzamide
CID 115613558
2-hydroxy-4-[(2-hydroxy-3-methoxybenzoyl)amino]butanoic acid
CID 114006239
(2S)-2-hydroxy-4-[(2-hydroxy-3-methoxybenzoyl)amino]butanoic acid
CID 114006576
2-hydroxy-3-methoxy-N-(2-pyrazol-1-ylethyl)benzamide
CID 61460888
N-(2,2-dimethylpropyl)-2-hydroxy-3-methoxybenzamide
CID 61166501

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide?
The IUPAC name of 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide (CID 61149422) is 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide.
What is the SMILES notation for 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide?
The canonical SMILES for 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide is CCCNC(=O)CCNC(=O)c1cccc(OC)c1O.
What is the InChIKey of 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide?
The InChIKey is GFPRJCIHVYCIPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-3-8-15-12(17)7-9-16-14(19)10-5-4-6-11(20-2)13(10)18/h4-6,18H,3,7-9H2,1-2H3,(H,15,17)(H,16,19).
What are the key properties of 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide?
2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide has a molecular weight of 280.32 g/mol, XLogP of 1.05, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methoxy-N-[3-oxo-3-(propylamino)propyl]benzamide is sourced from PubChem (CID 61149422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).