N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide

C19H25N3O3 — CID 109240183

IUPACN-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide
SMILESCCCCCNc1cncc(C(=O)Nc2cc(OC)ccc2OC)c1
InChIInChI=1S/C19H25N3O3/c1-4-5-6-9-21-15-10-14(12-20-13-15)19(23)22-17-11-16(24-2)7-8-18(17)25-3/h7-8,10-13,21H,4-6,9H2,1-3H3,(H,22,23)
InChIKeyGQNIFDFHIBNGSX-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.95
Rot. Bonds9

About N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide

N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide (PubChem CID 109240183) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide
PubChem CID109240183
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide
SMILESCCCCCNc1cncc(C(=O)Nc2cc(OC)ccc2OC)c1
InChIInChI=1S/C19H25N3O3/c1-4-5-6-9-21-15-10-14(12-20-13-15)19(23)22-17-11-16(24-2)7-8-18(17)25-3/h7-8,10-13,21H,4-6,9H2,1-3H3,(H,22,23)
InChIKeyGQNIFDFHIBNGSX-UHFFFAOYSA-N
XLogP3.95
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2,5-dimethoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228308
N-(5-chloro-2-methoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide
CID 109240172
5-(butylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109224665
N-(2,5-dimethoxyphenyl)-5-(3-methylbutylamino)pyridine-3-carboxamide
CID 109239954
5-(butylamino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109224662
N-(3-chloro-4-methoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide
CID 109240171
N-(2,5-dimethoxyphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109234341
5-[(4-chlorophenyl)methylamino]-N-(2,5-dimethoxyphenyl)pyridine-3-carboxamide
CID 109234136
N-(2-methoxy-5-methylphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236957
N-(2,5-dimethoxyphenyl)-5-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232174
N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228300
N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109244180

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide (CID 109240183) is N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide is CCCCCNc1cncc(C(=O)Nc2cc(OC)ccc2OC)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide?
The InChIKey is GQNIFDFHIBNGSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-4-5-6-9-21-15-10-14(12-20-13-15)19(23)22-17-11-16(24-2)7-8-18(17)25-3/h7-8,10-13,21H,4-6,9H2,1-3H3,(H,22,23).
What are the key properties of N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide?
N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 3.95, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109240183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).