6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide

C16H19N3O2 — CID 78956159

IUPAC6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCOc1ccccc1CNc1ccc(C(=O)N(C)C)cn1
InChIInChI=1S/C16H19N3O2/c1-19(2)16(20)13-8-9-15(18-11-13)17-10-12-6-4-5-7-14(12)21-3/h4-9,11H,10H2,1-3H3,(H,17,18)
InChIKeyNXYUZTRWVLFCTG-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.40
Rot. Bonds5

About 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide

6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 78956159) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide
PubChem CID78956159
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCOc1ccccc1CNc1ccc(C(=O)N(C)C)cn1
InChIInChI=1S/C16H19N3O2/c1-19(2)16(20)13-8-9-15(18-11-13)17-10-12-6-4-5-7-14(12)21-3/h4-9,11H,10H2,1-3H3,(H,17,18)
InChIKeyNXYUZTRWVLFCTG-UHFFFAOYSA-N
XLogP2.40
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2-hydroxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide
CID 115898968
6-[(2-methoxyphenyl)methylamino]-N-propylpyridine-3-carboxamide
CID 109151240
6-[(2-fluorophenyl)methylamino]-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109156428
N-[4-(dimethylamino)phenyl]-6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109157116
N-(2-fluorophenyl)-6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109157086
6-[(4-chlorophenyl)methylamino]-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109156901
2-ethyl-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]butanamide
CID 113012347
methyl 6-[(2-phenylmethoxyphenyl)methylamino]pyridine-3-carboxylate
CID 18791405
N-[(2-methoxyphenyl)methyl]-6-(pyridin-3-ylmethylamino)pyridine-3-carboxamide
CID 109157134
N-butyl-6-[2-(2-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
CID 109158752
N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]-2,2-dimethylpropanamide
CID 113012346
1-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]-3-phenylurea
CID 113012390

Frequently Asked Questions

What is the IUPAC name of 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide (CID 78956159) is 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide is COc1ccccc1CNc1ccc(C(=O)N(C)C)cn1.
What is the InChIKey of 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is NXYUZTRWVLFCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-19(2)16(20)13-8-9-15(18-11-13)17-10-12-6-4-5-7-14(12)21-3/h4-9,11H,10H2,1-3H3,(H,17,18).
What are the key properties of 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide?
6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methoxyphenyl)methylamino]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 78956159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).