N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide

C16H18N2O4 — CID 46663784

IUPACN-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide
SMILESCOc1cc(C(=O)Nc2ncccc2O)ccc1OC(C)C
InChIInChI=1S/C16H18N2O4/c1-10(2)22-13-7-6-11(9-14(13)21-3)16(20)18-15-12(19)5-4-8-17-15/h4-10,19H,1-3H3,(H,17,18,20)
InChIKeyFWSVSDCIOBOGBD-UHFFFAOYSA-N
MW302.33 g/mol
LogP2.84
Rot. Bonds5

About N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide

N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide (PubChem CID 46663784) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide
PubChem CID46663784
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC NameN-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide
SMILESCOc1cc(C(=O)Nc2ncccc2O)ccc1OC(C)C
InChIInChI=1S/C16H18N2O4/c1-10(2)22-13-7-6-11(9-14(13)21-3)16(20)18-15-12(19)5-4-8-17-15/h4-10,19H,1-3H3,(H,17,18,20)
InChIKeyFWSVSDCIOBOGBD-UHFFFAOYSA-N
XLogP2.84
TPSA80.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N'-(3-methoxy-4-propan-2-yloxybenzoyl)pyridine-3-carbohydrazide
CID 55559824
3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide
CID 6457881
N-(3,4-dichlorophenyl)-3-methoxy-4-propan-2-yloxybenzamide
CID 2223889
N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide
CID 25333159
4-ethoxy-3-methoxy-N-(3-methyl-2-pyridinyl)benzamide
CID 25344175
N-(3,4-difluorophenyl)-3-methoxy-4-propan-2-yloxybenzamide
CID 51159004
N'-acetyl-3-methoxy-4-propan-2-yloxybenzohydrazide
CID 46656614
3-methoxy-N-naphthalen-1-yl-4-propan-2-yloxybenzamide
CID 112762780
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 46674292
3-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 46511812
N-[2-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-methoxy-4-propan-2-yloxybenzamide
CID 55377881
N-(3-hydroxy-2-pyridinyl)-4-methylbenzamide
CID 25342946

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide?
The IUPAC name of N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide (CID 46663784) is N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide.
What is the SMILES notation for N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide?
The canonical SMILES for N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide is COc1cc(C(=O)Nc2ncccc2O)ccc1OC(C)C.
What is the InChIKey of N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide?
The InChIKey is FWSVSDCIOBOGBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-10(2)22-13-7-6-11(9-14(13)21-3)16(20)18-15-12(19)5-4-8-17-15/h4-10,19H,1-3H3,(H,17,18,20).
What are the key properties of N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide?
N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide has a molecular weight of 302.33 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide is sourced from PubChem (CID 46663784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).