N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide

C12H14N4O2 — CID 47298670

IUPACN-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide
SMILESCn1cc(CCC(=O)Nc2ncccc2O)cn1
InChIInChI=1S/C12H14N4O2/c1-16-8-9(7-14-16)4-5-11(18)15-12-10(17)3-2-6-13-12/h2-3,6-8,17H,4-5H2,1H3,(H,13,15,18)
InChIKeyCSUYALYCMYDYIF-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.09
Rot. Bonds4

About N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide

N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide (PubChem CID 47298670) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide
PubChem CID47298670
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC NameN-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide
SMILESCn1cc(CCC(=O)Nc2ncccc2O)cn1
InChIInChI=1S/C12H14N4O2/c1-16-8-9(7-14-16)4-5-11(18)15-12-10(17)3-2-6-13-12/h2-3,6-8,17H,4-5H2,1H3,(H,13,15,18)
InChIKeyCSUYALYCMYDYIF-UHFFFAOYSA-N
XLogP1.09
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-chloro-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide
CID 35531684
3-(1-methylpyrazol-4-yl)-N-(1,3-thiazol-2-yl)propanamide
CID 47298454
1-(1-methylpyrazol-4-yl)-5-pyridin-2-ylpentan-3-one
CID 103023920
N-(3-methoxyphenyl)-3-(1-methylpyrazol-4-yl)propanamide
CID 35532642
N-(3-hydroxy-2-pyridinyl)-3-naphthalen-2-ylpropanamide
CID 60521388
3-(1-methylpyrazol-4-yl)-N-naphthalen-2-ylpropanamide
CID 78905445
N-(1-methylpyrazol-4-yl)-3-pyridin-3-ylpropanamide
CID 32605738
N-(2-amino-4-fluorophenyl)-3-(1-methylpyrazol-4-yl)propanamide
CID 126583805
N-[[2-(2-fluorophenoxy)-3-pyridinyl]methyl]-3-(1-methylpyrazol-4-yl)propanamide
CID 25281555
N-(2,4-dichlorophenyl)-3-(1-methylpyrazol-4-yl)propanamide
CID 35591649
N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide
CID 60508064
3-(1-methylpyrazol-4-yl)-1-pyridin-3-ylpropan-1-one
CID 103007248

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide?
The IUPAC name of N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide (CID 47298670) is N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide.
What is the SMILES notation for N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide?
The canonical SMILES for N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide is Cn1cc(CCC(=O)Nc2ncccc2O)cn1.
What is the InChIKey of N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide?
The InChIKey is CSUYALYCMYDYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-16-8-9(7-14-16)4-5-11(18)15-12-10(17)3-2-6-13-12/h2-3,6-8,17H,4-5H2,1H3,(H,13,15,18).
What are the key properties of N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide?
N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide has a molecular weight of 246.27 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-pyridinyl)-3-(1-methylpyrazol-4-yl)propanamide is sourced from PubChem (CID 47298670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).