2-cyano-N-(1-methylpyrazol-3-yl)pentanamide

C10H14N4O — CID 55208289

IUPAC2-cyano-N-(1-methylpyrazol-3-yl)pentanamide
SMILESCCCC(C#N)C(=O)Nc1ccn(C)n1
InChIInChI=1S/C10H14N4O/c1-3-4-8(7-11)10(15)12-9-5-6-14(2)13-9/h5-6,8H,3-4H2,1-2H3,(H,12,13,15)
InChIKeyCEJZPOVWMMLXCK-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.30
Rot. Bonds4

About 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide

2-cyano-N-(1-methylpyrazol-3-yl)pentanamide (PubChem CID 55208289) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide.

Molecular Properties

Compound Name2-cyano-N-(1-methylpyrazol-3-yl)pentanamide
PubChem CID55208289
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name2-cyano-N-(1-methylpyrazol-3-yl)pentanamide
SMILESCCCC(C#N)C(=O)Nc1ccn(C)n1
InChIInChI=1S/C10H14N4O/c1-3-4-8(7-11)10(15)12-9-5-6-14(2)13-9/h5-6,8H,3-4H2,1-2H3,(H,12,13,15)
InChIKeyCEJZPOVWMMLXCK-UHFFFAOYSA-N
XLogP1.30
TPSA70.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-(1-methylpyrazol-3-yl)pentanamide
CID 93313980
(2R)-2-amino-N-(1-methylpyrazol-3-yl)propanamide
CID 78971987
(2S)-2-ethoxy-N-(1-methylpyrazol-3-yl)butanamide
CID 94181328
2-bromo-3-methyl-N-(1-methylpyrazol-3-yl)butanamide
CID 60810457
2-[(1-methylpyrazol-3-yl)amino]-N-pentan-2-ylacetamide
CID 79778666
(2R)-2-(4-cyanophenoxy)-N-(1-methylpyrazol-3-yl)propanamide
CID 25438347
3,3-difluoro-N-(1-methylpyrazol-3-yl)propanamide
CID 177229835
4-cyano-6-ethyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 46899099
2-[(1-methylpyrazol-3-yl)amino]-N-propylpropanamide
CID 112723457
1-(2-hydroxy-2-propylpentyl)-3-(1-methylpyrazol-3-yl)urea
CID 111437689
(2R)-2-(4-chlorophenyl)-3-methyl-N-(1-methylpyrazol-3-yl)butanamide
CID 25438052
N-(4-bromo-2-ethylphenyl)-2-cyanopentanamide
CID 81292095

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide?
The IUPAC name of 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide (CID 55208289) is 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide.
What is the SMILES notation for 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide?
The canonical SMILES for 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide is CCCC(C#N)C(=O)Nc1ccn(C)n1.
What is the InChIKey of 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide?
The InChIKey is CEJZPOVWMMLXCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-3-4-8(7-11)10(15)12-9-5-6-14(2)13-9/h5-6,8H,3-4H2,1-2H3,(H,12,13,15).
What are the key properties of 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide?
2-cyano-N-(1-methylpyrazol-3-yl)pentanamide has a molecular weight of 206.25 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-(1-methylpyrazol-3-yl)pentanamide is sourced from PubChem (CID 55208289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).