2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide

C14H20N2O4 — CID 115598366

IUPAC2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
SMILESCOc1cccc(C(=O)NCC(=O)NCC(C)C)c1O
InChIInChI=1S/C14H20N2O4/c1-9(2)7-15-12(17)8-16-14(19)10-5-4-6-11(20-3)13(10)18/h4-6,9,18H,7-8H2,1-3H3,(H,15,17)(H,16,19)
InChIKeyHDPZMFGKOIIBDC-UHFFFAOYSA-N
MW280.32 g/mol
LogP0.90
Rot. Bonds6

About 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide

2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide (PubChem CID 115598366) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
PubChem CID115598366
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
SMILESCOc1cccc(C(=O)NCC(=O)NCC(C)C)c1O
InChIInChI=1S/C14H20N2O4/c1-9(2)7-15-12(17)8-16-14(19)10-5-4-6-11(20-3)13(10)18/h4-6,9,18H,7-8H2,1-3H3,(H,15,17)(H,16,19)
InChIKeyHDPZMFGKOIIBDC-UHFFFAOYSA-N
XLogP0.90
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[2-oxo-2-(2-phenylpropylamino)ethyl]benzamide
CID 42910698
N-(2-ethylbutyl)-2-hydroxy-3-methoxybenzamide
CID 115613558
2-hydroxy-3-methoxy-N-[3-oxo-3-(propan-2-ylamino)propyl]benzamide
CID 115670745
N-(4-amino-2-methylbutyl)-2-hydroxy-3-methoxybenzamide
CID 66090450
3-hydroxy-4-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
CID 115674974
N-(2-cyclopropylpropyl)-2-hydroxy-3-methoxybenzamide
CID 115591215
2-fluoro-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
CID 40623473
2-[[2-(2-methoxyphenoxy)acetyl]amino]-N-(2-methylpropyl)acetamide
CID 49167933
2-hydroxy-3-methoxy-N-(5-methylhexan-2-yl)benzamide
CID 60653927
N-(2,2-dimethylpropyl)-2-hydroxy-3-methoxybenzamide
CID 61166501
N-[2-(ethylamino)-2-oxoethyl]-2-methoxybenzamide
CID 2687892
2-(difluoromethoxy)-3-methoxy-N-(2-methylpropyl)benzamide
CID 134059564

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide?
The IUPAC name of 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide (CID 115598366) is 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide is COc1cccc(C(=O)NCC(=O)NCC(C)C)c1O.
What is the InChIKey of 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide?
The InChIKey is HDPZMFGKOIIBDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-9(2)7-15-12(17)8-16-14(19)10-5-4-6-11(20-3)13(10)18/h4-6,9,18H,7-8H2,1-3H3,(H,15,17)(H,16,19).
What are the key properties of 2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide?
2-hydroxy-3-methoxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide has a molecular weight of 280.32 g/mol, XLogP of 0.90, 6 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-[2-(2-methylpropylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 115598366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).