4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide

C13H17N5O — CID 167948266

IUPAC4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide
SMILESCc1ccnc(NCCCn2cccn2)c1C(N)=O
InChIInChI=1S/C13H17N5O/c1-10-4-7-16-13(11(10)12(14)19)15-5-2-8-18-9-3-6-17-18/h3-4,6-7,9H,2,5,8H2,1H3,(H2,14,19)(H,15,16)
InChIKeyWWIOUMZTCKRQHU-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.19
Rot. Bonds6

About 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide

4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide (PubChem CID 167948266) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide
PubChem CID167948266
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide
SMILESCc1ccnc(NCCCn2cccn2)c1C(N)=O
InChIInChI=1S/C13H17N5O/c1-10-4-7-16-13(11(10)12(14)19)15-5-2-8-18-9-3-6-17-18/h3-4,6-7,9H,2,5,8H2,1H3,(H2,14,19)(H,15,16)
InChIKeyWWIOUMZTCKRQHU-UHFFFAOYSA-N
XLogP1.19
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-[(3-carbamoyl-4-methyl-2-pyridinyl)amino]-2-methylpentanoic acid
CID 104683248
3-(3-pyrazol-1-ylpropylamino)pyrazine-2-carboxylic acid
CID 113413256
N-(3-pyrazol-1-ylpropyl)-3-(trifluoromethyl)pyridin-2-amine
CID 115579994
5-bromo-3-methyl-N-(3-pyrazol-1-ylpropyl)pyridin-2-amine
CID 112697448
3-(3-pyrazol-1-ylpropylamino)-1H-pyrazin-2-one
CID 115657026
3-nitro-N-(3-pyrazol-1-ylpropyl)pyridin-2-amine
CID 112684451
3-bromo-4-methyl-2-N-(3-pyrazol-1-ylpropyl)pyridine-2,5-diamine
CID 113420539
6-methoxy-N-(3-pyrazol-1-ylpropyl)isoquinolin-1-amine
CID 106539434
2-(2-ethylsulfonylethylamino)-4-methylpyridine-3-carboxylic acid
CID 114112447
2-(4-methylphenoxy)-N-(3-pyrazol-1-ylpropyl)acetamide
CID 47025675
N-ethyl-6-(3-pyrazol-1-ylpropylamino)pyridazine-3-carboxamide
CID 115690608
6-methyl-3-nitro-N-(3-pyrazol-1-ylpropyl)pyridin-2-amine
CID 115714662

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide?
The IUPAC name of 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide (CID 167948266) is 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide is Cc1ccnc(NCCCn2cccn2)c1C(N)=O.
What is the InChIKey of 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide?
The InChIKey is WWIOUMZTCKRQHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-10-4-7-16-13(11(10)12(14)19)15-5-2-8-18-9-3-6-17-18/h3-4,6-7,9H,2,5,8H2,1H3,(H2,14,19)(H,15,16).
What are the key properties of 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide?
4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.19, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(3-pyrazol-1-ylpropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 167948266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).