5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide

C19H21N3O3 — CID 126648561

IUPAC5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CCC2)cnc1OCc1ccccc1
InChIInChI=1S/C19H21N3O3/c1-20-18(24)16-10-14(17(23)22-15-8-5-9-15)11-21-19(16)25-12-13-6-3-2-4-7-13/h2-4,6-7,10-11,15H,5,8-9,12H2,1H3,(H,20,24)(H,22,23)
InChIKeyQQKNDEXPZJKEIS-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.30
Rot. Bonds6

About 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide

5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide (PubChem CID 126648561) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide
PubChem CID126648561
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CCC2)cnc1OCc1ccccc1
InChIInChI=1S/C19H21N3O3/c1-20-18(24)16-10-14(17(23)22-15-8-5-9-15)11-21-19(16)25-12-13-6-3-2-4-7-13/h2-4,6-7,10-11,15H,5,8-9,12H2,1H3,(H,20,24)(H,22,23)
InChIKeyQQKNDEXPZJKEIS-UHFFFAOYSA-N
XLogP2.30
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-cyclopropyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide
CID 126648449
N-cyclohexyl-4-(phenoxymethyl)benzamide
CID 40606245
N-cyclobutyl-6-[(3-methylphenyl)methoxy]pyridine-3-carboxamide
CID 58368099
N-cyclopentyl-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 1447863
N-(4-hydroxycyclohexyl)-3-phenylmethoxybenzamide
CID 17447563
N-methyl-5-phenylmethoxypyridine-3-carboxamide
CID 123214761
methyl 5-[(Z)-1-amino-2-[amino(methyl)amino]ethenyl]-2-phenylmethoxypyridine-3-carboxylate
CID 144867120
4-benzyl-N-cyclopropylbenzamide
CID 45086871
1-benzyl-5-N-[(1S,3R)-3-hydroxycyclohexyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
CID 135323832
4-amino-N-cyclopentyl-2-phenylmethoxybenzamide
CID 146035949
4-[(2-phenylmethoxypyridine-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 120524557
2-(ethylamino)-N-[(1R,2R)-2-phenylmethoxycyclopentyl]pyrimidine-5-carboxamide
CID 74230622

Frequently Asked Questions

What is the IUPAC name of 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide (CID 126648561) is 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide is CNC(=O)c1cc(C(=O)NC2CCC2)cnc1OCc1ccccc1.
What is the InChIKey of 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide?
The InChIKey is QQKNDEXPZJKEIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-20-18(24)16-10-14(17(23)22-15-8-5-9-15)11-21-19(16)25-12-13-6-3-2-4-7-13/h2-4,6-7,10-11,15H,5,8-9,12H2,1H3,(H,20,24)(H,22,23).
What are the key properties of 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide?
5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide has a molecular weight of 339.40 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclobutyl-3-N-methyl-2-phenylmethoxypyridine-3,5-dicarboxamide is sourced from PubChem (CID 126648561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).