N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide

C16H19N3O — CID 106910201

IUPACN-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide
SMILESCCNCc1ccc(NC(=O)c2ccc(C)nc2)cc1
InChIInChI=1S/C16H19N3O/c1-3-17-10-13-5-8-15(9-6-13)19-16(20)14-7-4-12(2)18-11-14/h4-9,11,17H,3,10H2,1-2H3,(H,19,20)
InChIKeyXHGGEKDSHUKELE-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.75
Rot. Bonds5

About N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide

N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide (PubChem CID 106910201) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide
PubChem CID106910201
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide
SMILESCCNCc1ccc(NC(=O)c2ccc(C)nc2)cc1
InChIInChI=1S/C16H19N3O/c1-3-17-10-13-5-8-15(9-6-13)19-16(20)14-7-4-12(2)18-11-14/h4-9,11,17H,3,10H2,1-2H3,(H,19,20)
InChIKeyXHGGEKDSHUKELE-UHFFFAOYSA-N
XLogP2.75
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(bromomethyl)phenyl]-6-methylpyridine-3-carboxamide
CID 113274656
N-[4-(2-hydroxyethyl)phenyl]-6-methylpyridine-3-carboxamide
CID 51985113
methyl 4-[(6-methylpyridine-3-carbonyl)amino]benzoate
CID 18148097
N-[4-(ethylaminomethyl)phenyl]pyridine-4-carboxamide
CID 106910118
propyl 4-[(6-methylpyridine-3-carbonyl)amino]benzoate
CID 51331436
6-methyl-N-[4-(phenylcarbamoylamino)phenyl]pyridine-3-carboxamide
CID 38477101
N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide;methylsulfanylethane;propane
CID 143393638
N-[4-(2-hydroxyethoxy)phenyl]-6-methylpyridine-3-carboxamide
CID 111113144
6-amino-N-(4-propylphenyl)pyridine-3-carboxamide
CID 62154771
6-(ethylamino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 62166937
N-[4-(ethylaminomethyl)phenyl]pyridine-2-carboxamide
CID 106910172
N-[(4-fluorophenyl)methyl]-6-methylpyridine-3-carboxamide
CID 18148195

Frequently Asked Questions

What is the IUPAC name of N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide (CID 106910201) is N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide is CCNCc1ccc(NC(=O)c2ccc(C)nc2)cc1.
What is the InChIKey of N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide?
The InChIKey is XHGGEKDSHUKELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-17-10-13-5-8-15(9-6-13)19-16(20)14-7-4-12(2)18-11-14/h4-9,11,17H,3,10H2,1-2H3,(H,19,20).
What are the key properties of N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide?
N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(ethylaminomethyl)phenyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 106910201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).