N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide

C13H17N5O — CID 102807240

IUPACN-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)Nc1cn(C)nc1C
InChIInChI=1S/C13H17N5O/c1-4-14-12-10(6-5-7-15-12)13(19)16-11-8-18(3)17-9(11)2/h5-8H,4H2,1-3H3,(H,14,15)(H,16,19)
InChIKeyOLEDGJZVJKOUKI-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.81
Rot. Bonds4

About N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide

N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide (PubChem CID 102807240) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide
PubChem CID102807240
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC NameN-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)Nc1cn(C)nc1C
InChIInChI=1S/C13H17N5O/c1-4-14-12-10(6-5-7-15-12)13(19)16-11-8-18(3)17-9(11)2/h5-8H,4H2,1-3H3,(H,14,15)(H,16,19)
InChIKeyOLEDGJZVJKOUKI-UHFFFAOYSA-N
XLogP1.81
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3-dimethylpyrazol-4-yl)-2-fluorobenzamide
CID 39854004
2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 55209117
2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide
CID 62185386
N-(2-methyl-3-pyridinyl)-2-(propylamino)pyridine-3-carboxamide
CID 79043163
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(ethylamino)pyridine-3-carboxamide
CID 62178330
3-amino-N-(1,3-dimethylpyrazol-4-yl)-2-ethoxybenzamide
CID 102803184
N-(2-bromo-3-chlorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 103481392
2-(ethylamino)-N-pyrimidin-5-ylpyridine-3-carboxamide
CID 107589901
N-(1,3-dimethylpyrazol-4-yl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107377186
2-(ethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 62166695
N-(4-bromo-2,5-difluorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 107616528
N-(2-bromo-5-fluorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 107631593

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide (CID 102807240) is N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide is CCNc1ncccc1C(=O)Nc1cn(C)nc1C.
What is the InChIKey of N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide?
The InChIKey is OLEDGJZVJKOUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-4-14-12-10(6-5-7-15-12)13(19)16-11-8-18(3)17-9(11)2/h5-8H,4H2,1-3H3,(H,14,15)(H,16,19).
What are the key properties of N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide?
N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpyrazol-4-yl)-2-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 102807240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).