N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide

C14H19N5O — CID 71998211

IUPACN-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCC(C)Nc1ncccc1C(=O)NCc1ccnn1C
InChIInChI=1S/C14H19N5O/c1-10(2)18-13-12(5-4-7-15-13)14(20)16-9-11-6-8-17-19(11)3/h4-8,10H,9H2,1-3H3,(H,15,18)(H,16,20)
InChIKeyZYGJYGLIYMLIMX-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.57
Rot. Bonds5

About N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide

N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide (PubChem CID 71998211) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide
PubChem CID71998211
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC NameN-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCC(C)Nc1ncccc1C(=O)NCc1ccnn1C
InChIInChI=1S/C14H19N5O/c1-10(2)18-13-12(5-4-7-15-13)14(20)16-9-11-6-8-17-19(11)3/h4-8,10H,9H2,1-3H3,(H,15,18)(H,16,20)
InChIKeyZYGJYGLIYMLIMX-UHFFFAOYSA-N
XLogP1.57
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide?
The IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide (CID 71998211) is N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide is CC(C)Nc1ncccc1C(=O)NCc1ccnn1C.
What is the InChIKey of N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide?
The InChIKey is ZYGJYGLIYMLIMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-10(2)18-13-12(5-4-7-15-13)14(20)16-9-11-6-8-17-19(11)3/h4-8,10H,9H2,1-3H3,(H,15,18)(H,16,20).
What are the key properties of N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide?
N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrazol-3-yl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 71998211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).