N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide

C16H19N3O2 — CID 81237400

IUPACN-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccncc1C(=O)Nc1cccc(OCC)c1
InChIInChI=1S/C16H19N3O2/c1-3-18-15-8-9-17-11-14(15)16(20)19-12-6-5-7-13(10-12)21-4-2/h5-11H,3-4H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyIMMJAERFJZLALL-UHFFFAOYSA-N
MW285.35 g/mol
LogP3.16
Rot. Bonds6

About N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide

N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide (PubChem CID 81237400) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide
PubChem CID81237400
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccncc1C(=O)Nc1cccc(OCC)c1
InChIInChI=1S/C16H19N3O2/c1-3-18-15-8-9-17-11-14(15)16(20)19-12-6-5-7-13(10-12)21-4-2/h5-11H,3-4H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyIMMJAERFJZLALL-UHFFFAOYSA-N
XLogP3.16
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(ethylamino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 81235983
4-(ethylamino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 81236169
N-(4-ethoxyphenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105067886
N-(4-ethoxyphenyl)-4-hydrazinylpyridine-3-carboxamide
CID 81256247
4-(ethylamino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 81235788
N-(3-ethoxyphenyl)-2-hydrazinylbenzamide
CID 62247314
N-(3-bromo-4-chlorophenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81245404
N-(3-ethoxyphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380453
2-[(3-ethoxyphenyl)carbamoyl]benzoic acid
CID 17098079
N-(2,3-dihydro-1H-inden-5-yl)-4-(ethylamino)pyridine-3-carboxamide
CID 81239690
5-bromo-N-(3-ethoxyphenyl)pyridine-3-carboxamide
CID 61061483
4-(ethylamino)-N-(4-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 81241556

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide (CID 81237400) is N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide is CCNc1ccncc1C(=O)Nc1cccc(OCC)c1.
What is the InChIKey of N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide?
The InChIKey is IMMJAERFJZLALL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-3-18-15-8-9-17-11-14(15)16(20)19-12-6-5-7-13(10-12)21-4-2/h5-11H,3-4H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide?
N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyphenyl)-4-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81237400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).