N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide

C19H23N3O3 — CID 6498672

IUPACN-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide
SMILESCOc1c(C)cccc1C(=O)NCCCNC(=O)c1ccc(C)nc1
InChIInChI=1S/C19H23N3O3/c1-13-6-4-7-16(17(13)25-3)19(24)21-11-5-10-20-18(23)15-9-8-14(2)22-12-15/h4,6-9,12H,5,10-11H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyZYNRNQHIUXYESD-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.26
Rot. Bonds7

About N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide

N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide (PubChem CID 6498672) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide
PubChem CID6498672
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide
SMILESCOc1c(C)cccc1C(=O)NCCCNC(=O)c1ccc(C)nc1
InChIInChI=1S/C19H23N3O3/c1-13-6-4-7-16(17(13)25-3)19(24)21-11-5-10-20-18(23)15-9-8-14(2)22-12-15/h4,6-9,12H,5,10-11H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyZYNRNQHIUXYESD-UHFFFAOYSA-N
XLogP2.26
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Picotamide
CID 4814
Piclozotan
CID 9801640
Picotamide monohydrate
CID 6419975
N-{2-(4-Methoxy-phenyl)-1-[(pyridin-3-ylmethyl)-carbamoyl]-vinyl}-benzamide
CID 5442665
6-(3-methoxyphenyl)-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]pyridine-3-carboxamide
CID 59743926
2-methoxy-N-pyridin-4-ylbenzamide
CID 814758
2,6-dimethoxy-N-pyridin-4-ylbenzamide
CID 825634
N-(3-methoxyphenyl)nicotinamide
CID 668900
N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 532821
3-Carbamyl-(3'-picolyl)-4-methoxy-1-benzamide
CID 130587
6-(2-fluoranylpyridin-4-yl)-~{N}-[(1~{R})-1-(3-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 168276974
(2S)-N-{2-[(4-methoxyphenyl)amino]ethyl}-2-[(3-methylphenyl)formamido]-3-(pyridin-3-yl)propanamide
CID 23648324

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide (CID 6498672) is N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide is COc1c(C)cccc1C(=O)NCCCNC(=O)c1ccc(C)nc1.
What is the InChIKey of N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide?
The InChIKey is ZYNRNQHIUXYESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-13-6-4-7-16(17(13)25-3)19(24)21-11-5-10-20-18(23)15-9-8-14(2)22-12-15/h4,6-9,12H,5,10-11H2,1-3H3,(H,20,23)(H,21,24).
What are the key properties of N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide?
N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.26, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-methoxy-3-methylbenzoyl)amino]propyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 6498672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).