2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide

C17H21N3O — CID 62175582

IUPAC2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(C)Cc2ccccc2C)ccn1
InChIInChI=1S/C17H21N3O/c1-4-18-16-11-14(9-10-19-16)17(21)20(3)12-15-8-6-5-7-13(15)2/h5-11H,4,12H2,1-3H3,(H,18,19)
InChIKeyNNZQDUCPOYGKFU-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.09
Rot. Bonds5

About 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide

2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide (PubChem CID 62175582) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
PubChem CID62175582
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(C)Cc2ccccc2C)ccn1
InChIInChI=1S/C17H21N3O/c1-4-18-16-11-14(9-10-19-16)17(21)20(3)12-15-8-6-5-7-13(15)2/h5-11H,4,12H2,1-3H3,(H,18,19)
InChIKeyNNZQDUCPOYGKFU-UHFFFAOYSA-N
XLogP3.09
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyano-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 115115897
2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 55047494
4-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 62175917
N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
CID 62172696
N-[2-(dimethylamino)ethyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
CID 109167652
2-imidazol-1-yl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 51089957
2-[2-(2-methylphenyl)ethylamino]pyridine-4-carboxylic acid
CID 112723330
2-(ethylamino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 62184923
N-benzyl-N-methyl-2-(pentylamino)pyridine-4-carboxamide
CID 109170237
2-(ethylamino)-N-(3-hydroxybutyl)-N-methylpyridine-4-carboxamide
CID 115704020
3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 60636386
2-(ethylamino)-N,N-dipropylpyridine-4-carboxamide
CID 62167745

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide (CID 62175582) is 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide is CCNc1cc(C(=O)N(C)Cc2ccccc2C)ccn1.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide?
The InChIKey is NNZQDUCPOYGKFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-4-18-16-11-14(9-10-19-16)17(21)20(3)12-15-8-6-5-7-13(15)2/h5-11H,4,12H2,1-3H3,(H,18,19).
What are the key properties of 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide?
2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide has a molecular weight of 283.38 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 62175582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).