N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide

C17H21N3O3 — CID 109179771

IUPACN-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(NC(C)C)cn2)c1
InChIInChI=1S/C17H21N3O3/c1-11(2)19-12-5-7-14(18-10-12)17(21)20-15-9-13(22-3)6-8-16(15)23-4/h5-11,19H,1-4H3,(H,20,21)
InChIKeyRDSGRNFNTKLWAS-UHFFFAOYSA-N
MW315.37 g/mol
LogP3.17
Rot. Bonds6

About N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide

N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide (PubChem CID 109179771) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide
PubChem CID109179771
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC NameN-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(NC(C)C)cn2)c1
InChIInChI=1S/C17H21N3O3/c1-11(2)19-12-5-7-14(18-10-12)17(21)20-15-9-13(22-3)6-8-16(15)23-4/h5-11,19H,1-4H3,(H,20,21)
InChIKeyRDSGRNFNTKLWAS-UHFFFAOYSA-N
XLogP3.17
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide
CID 109179760
N-(2,5-dimethoxyphenyl)-5-(2-methylpropylamino)pyridine-2-carboxamide
CID 109181332
N-(2,5-dimethoxyphenyl)-5-(propylamino)pyridine-2-carboxamide
CID 109179374
N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109200105
N-(2,5-dimethoxyphenyl)-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190528
N-(2,5-dimethoxyphenyl)-5-(2,6-dimethylanilino)pyridine-2-carboxamide
CID 109198260
N-(2,5-dimethoxyphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190329
5-(5-chloro-2-methylanilino)-N-(2,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 109199397
N-(2-chlorophenyl)-5-(2,5-dimethoxyanilino)pyridine-2-carboxamide
CID 109199091
N-(2,5-dimethoxyphenyl)-6-methoxypyridazine-3-carboxamide
CID 90509292
N-(2,5-dimethoxyphenyl)isoquinoline-3-carboxamide
CID 110860541
N-(2,5-dimethoxyphenyl)-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185219

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide (CID 109179771) is N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide is COc1ccc(OC)c(NC(=O)c2ccc(NC(C)C)cn2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide?
The InChIKey is RDSGRNFNTKLWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-11(2)19-12-5-7-14(18-10-12)17(21)20-15-9-13(22-3)6-8-16(15)23-4/h5-11,19H,1-4H3,(H,20,21).
What are the key properties of N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide?
N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide has a molecular weight of 315.37 g/mol, XLogP of 3.17, 6 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-(propan-2-ylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109179771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).