N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide

C17H21N3O — CID 43507835

IUPACN-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide
SMILESCCNC(C)c1cccc(NC(=O)c2cccc(C)n2)c1
InChIInChI=1S/C17H21N3O/c1-4-18-13(3)14-8-6-9-15(11-14)20-17(21)16-10-5-7-12(2)19-16/h5-11,13,18H,4H2,1-3H3,(H,20,21)
InChIKeyIBIVOWSPVPFBRP-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.31
Rot. Bonds5

About N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide

N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide (PubChem CID 43507835) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide
PubChem CID43507835
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC NameN-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide
SMILESCCNC(C)c1cccc(NC(=O)c2cccc(C)n2)c1
InChIInChI=1S/C17H21N3O/c1-4-18-13(3)14-8-6-9-15(11-14)20-17(21)16-10-5-7-12(2)19-16/h5-11,13,18H,4H2,1-3H3,(H,20,21)
InChIKeyIBIVOWSPVPFBRP-UHFFFAOYSA-N
XLogP3.31
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[1-(ethylamino)ethyl]phenyl]-1,3-dimethylpyrazole-4-carboxamide
CID 102801384
N-[3-[1-(ethylamino)ethyl]phenyl]-1H-pyrazole-4-carboxamide
CID 55182293
N-[3-[1-(ethylamino)ethyl]phenyl]-2-methylpropanamide
CID 43507815
N-(3-chlorophenyl)-6-methylpyridine-2-carboxamide
CID 31698646
N-[3-[1-(ethylamino)ethyl]phenyl]-2-methylbutanamide
CID 43507836
N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide
CID 43507845
N-[3-[1-(ethylamino)ethyl]phenyl]furan-3-carboxamide
CID 43507852
1-[3-[1-(ethylamino)ethyl]phenyl]-3-pentan-3-ylurea
CID 61340352
N-(3-formylphenyl)-6-methylpyridine-2-carboxamide
CID 106912611
N-[3-ethyl-4-(2-methylbutanoyl)phenyl]-6-methylpyridine-2-carboxamide
CID 170731792
2-methyl-N-[3-[1-(propylamino)ethyl]phenyl]furan-3-carboxamide
CID 43507889
2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide
CID 61466725

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide?
The IUPAC name of N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide (CID 43507835) is N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide is CCNC(C)c1cccc(NC(=O)c2cccc(C)n2)c1.
What is the InChIKey of N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide?
The InChIKey is IBIVOWSPVPFBRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-4-18-13(3)14-8-6-9-15(11-14)20-17(21)16-10-5-7-12(2)19-16/h5-11,13,18H,4H2,1-3H3,(H,20,21).
What are the key properties of N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide?
N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide has a molecular weight of 283.38 g/mol, XLogP of 3.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 43507835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).