N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide

C16H17N3O3 — CID 108925343

IUPACN-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide
SMILESCOCCC(=O)Nc1ccccc1NC(=O)c1cccnc1
InChIInChI=1S/C16H17N3O3/c1-22-10-8-15(20)18-13-6-2-3-7-14(13)19-16(21)12-5-4-9-17-11-12/h2-7,9,11H,8,10H2,1H3,(H,18,20)(H,19,21)
InChIKeyROEXJXGISXXXQS-UHFFFAOYSA-N
MW299.33 g/mol
LogP2.31
Rot. Bonds6

About N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide

N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide (PubChem CID 108925343) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide
PubChem CID108925343
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC NameN-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide
SMILESCOCCC(=O)Nc1ccccc1NC(=O)c1cccnc1
InChIInChI=1S/C16H17N3O3/c1-22-10-8-15(20)18-13-6-2-3-7-14(13)19-16(21)12-5-4-9-17-11-12/h2-7,9,11H,8,10H2,1H3,(H,18,20)(H,19,21)
InChIKeyROEXJXGISXXXQS-UHFFFAOYSA-N
XLogP2.31
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(3-methoxypropanoylamino)methyl]phenyl]pyridine-3-carboxamide
CID 108926036
N-[2-[4-(2-methylphenoxy)butanoylamino]phenyl]pyridine-3-carboxamide
CID 108925317
N-[2-[3-(4-methylphenyl)propanoylamino]phenyl]pyridine-3-carboxamide
CID 108925345
N-[2-[[2-(3-methoxyphenyl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925379
N-[2-[(2-benzamidoacetyl)amino]phenyl]pyridine-3-carboxamide
CID 108925269
N-[2-[[[2-(2-methoxyethoxy)acetyl]amino]methyl]phenyl]pyridine-3-carboxamide
CID 108926070
N-naphthalen-1-ylpyridine-3-carboxamide
CID 532824
N-[2-[(4-tert-butylbenzoyl)amino]phenyl]pyridine-3-carboxamide
CID 31974220
N-[3-[(3-methoxypropanoylamino)methyl]phenyl]pyridine-3-carboxamide
CID 108926397
N-[2-(pyridine-3-carbonylamino)phenyl]pyridine-2-carboxamide
CID 108925361
N-(2-tert-butylphenyl)pyridine-3-carboxamide
CID 1244993
3-[2-(pyridine-3-carbonylamino)phenyl]propanoic acid
CID 107272327

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide (CID 108925343) is N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide is COCCC(=O)Nc1ccccc1NC(=O)c1cccnc1.
What is the InChIKey of N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide?
The InChIKey is ROEXJXGISXXXQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-22-10-8-15(20)18-13-6-2-3-7-14(13)19-16(21)12-5-4-9-17-11-12/h2-7,9,11H,8,10H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide?
N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 2.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxypropanoylamino)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 108925343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).