N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide

C16H19N3O2 — CID 106486623

IUPACN,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide
SMILESCNCc1cccc(Oc2ccnc(C(=O)N(C)C)c2)c1
InChIInChI=1S/C16H19N3O2/c1-17-11-12-5-4-6-13(9-12)21-14-7-8-18-15(10-14)16(20)19(2)3/h4-10,17H,11H2,1-3H3
InChIKeyZUYPKUOYAQQKHR-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.30
Rot. Bonds5

About N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide

N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide (PubChem CID 106486623) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide
PubChem CID106486623
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide
SMILESCNCc1cccc(Oc2ccnc(C(=O)N(C)C)c2)c1
InChIInChI=1S/C16H19N3O2/c1-17-11-12-5-4-6-13(9-12)21-14-7-8-18-15(10-14)16(20)19(2)3/h4-10,17H,11H2,1-3H3
InChIKeyZUYPKUOYAQQKHR-UHFFFAOYSA-N
XLogP2.30
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 ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-bromophenoxy)-N,N-dimethylpyridine-2-carboxamide
CID 43395714
4-(3-ethylphenoxy)pyridine-2-carboxylic acid
CID 43326028
methyl 4-[3-(aminomethyl)phenoxy]pyridine-2-carboxylate
CID 106485855
2-[3-(methylaminomethyl)phenoxy]pyridine-4-carboxamide
CID 106486567
4-[3-(2-aminoethyl)phenoxy]-N-methylpyridine-2-carboxamide
CID 59685040
N,N-dimethyl-3-(methylaminomethyl)benzamide
CID 83814364
4-[3-[2-[[4-(dimethylamino)benzoyl]amino]ethyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 25051896
N-methyl-4-[3-[[(4-methylsulfanylphenyl)carbamoylamino]methyl]phenoxy]pyridine-2-carboxamide
CID 10454929
N,N-diethyl-4-(3-hydroxyphenoxy)pyridine-2-carboxamide
CID 60871058
4-(4-amino-3-chlorophenoxy)-N,N-dimethylpyridine-2-carboxamide
CID 62113277
2-[3-(methylaminomethyl)phenoxy]pyridine-3-carboxamide
CID 106486329
4-[2-(3-ethylanilino)-1-methylbenzimidazol-5-yl]oxy-N,N-dimethylpyridine-2-carboxamide
CID 21037188

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide?
The IUPAC name of N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide (CID 106486623) is N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide is CNCc1cccc(Oc2ccnc(C(=O)N(C)C)c2)c1.
What is the InChIKey of N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide?
The InChIKey is ZUYPKUOYAQQKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-17-11-12-5-4-6-13(9-12)21-14-7-8-18-15(10-14)16(20)19(2)3/h4-10,17H,11H2,1-3H3.
What are the key properties of N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide?
N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide is sourced from PubChem (CID 106486623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).