N-(4-methyl-1H-pyrazol-5-yl)nonanamide

C13H23N3O — CID 112691253

IUPACN-(4-methyl-1H-pyrazol-5-yl)nonanamide
SMILESCCCCCCCCC(=O)Nc1[nH]ncc1C
InChIInChI=1S/C13H23N3O/c1-3-4-5-6-7-8-9-12(17)15-13-11(2)10-14-16-13/h10H,3-9H2,1-2H3,(H2,14,15,16,17)
InChIKeyMYRZWWYTYPKLEQ-UHFFFAOYSA-N
MW237.35 g/mol
LogP3.41
Rot. Bonds8

About N-(4-methyl-1H-pyrazol-5-yl)nonanamide

N-(4-methyl-1H-pyrazol-5-yl)nonanamide (PubChem CID 112691253) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is N-(4-methyl-1H-pyrazol-5-yl)nonanamide.

Molecular Properties

Compound NameN-(4-methyl-1H-pyrazol-5-yl)nonanamide
PubChem CID112691253
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC NameN-(4-methyl-1H-pyrazol-5-yl)nonanamide
SMILESCCCCCCCCC(=O)Nc1[nH]ncc1C
InChIInChI=1S/C13H23N3O/c1-3-4-5-6-7-8-9-12(17)15-13-11(2)10-14-16-13/h10H,3-9H2,1-2H3,(H2,14,15,16,17)
InChIKeyMYRZWWYTYPKLEQ-UHFFFAOYSA-N
XLogP3.41
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)butanamide
CID 104621856
N-(4-methyl-1H-pyrazol-5-yl)-3-propoxypropanamide
CID 104620175
N-(5-methyl-1H-pyrazol-3-yl)nonanamide
CID 47289748
N-(4-methyl-1H-pyrazol-5-yl)-3-pyridin-4-ylpropanamide
CID 112691455
6-amino-4-methyl-N-(4-methyl-1H-pyrazol-5-yl)hexanamide
CID 104619007
5-chloro-N-(4-ethyl-1H-pyrazol-5-yl)pentanamide
CID 104617778
ethyl N-(4-methyl-1H-pyrazol-5-yl)carbamate
CID 115630334
N-(2-hydroxy-4,5-dimethylphenyl)tetradecanamide
CID 20778606
2-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115629912
N-(3,4-dimethylphenyl)dodecanamide
CID 4067786
N-(2,6-dimethylphenyl)tetradecanamide
CID 54789598
3-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
CID 115630345

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1H-pyrazol-5-yl)nonanamide?
The IUPAC name of N-(4-methyl-1H-pyrazol-5-yl)nonanamide (CID 112691253) is N-(4-methyl-1H-pyrazol-5-yl)nonanamide.
What is the SMILES notation for N-(4-methyl-1H-pyrazol-5-yl)nonanamide?
The canonical SMILES for N-(4-methyl-1H-pyrazol-5-yl)nonanamide is CCCCCCCCC(=O)Nc1[nH]ncc1C.
What is the InChIKey of N-(4-methyl-1H-pyrazol-5-yl)nonanamide?
The InChIKey is MYRZWWYTYPKLEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-3-4-5-6-7-8-9-12(17)15-13-11(2)10-14-16-13/h10H,3-9H2,1-2H3,(H2,14,15,16,17).
What are the key properties of N-(4-methyl-1H-pyrazol-5-yl)nonanamide?
N-(4-methyl-1H-pyrazol-5-yl)nonanamide has a molecular weight of 237.35 g/mol, XLogP of 3.41, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1H-pyrazol-5-yl)nonanamide is sourced from PubChem (CID 112691253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).