N-(1H-indazol-7-yl)-5-methoxypentanamide

C13H17N3O2 — CID 86871615

IUPACN-(1H-indazol-7-yl)-5-methoxypentanamide
SMILESCOCCCCC(=O)Nc1cccc2cn[nH]c12
InChIInChI=1S/C13H17N3O2/c1-18-8-3-2-7-12(17)15-11-6-4-5-10-9-14-16-13(10)11/h4-6,9H,2-3,7-8H2,1H3,(H,14,16)(H,15,17)
InChIKeyKQEZZUALGQCLPR-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.32
Rot. Bonds6

About N-(1H-indazol-7-yl)-5-methoxypentanamide

N-(1H-indazol-7-yl)-5-methoxypentanamide (PubChem CID 86871615) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is N-(1H-indazol-7-yl)-5-methoxypentanamide.

Molecular Properties

Compound NameN-(1H-indazol-7-yl)-5-methoxypentanamide
PubChem CID86871615
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC NameN-(1H-indazol-7-yl)-5-methoxypentanamide
SMILESCOCCCCC(=O)Nc1cccc2cn[nH]c12
InChIInChI=1S/C13H17N3O2/c1-18-8-3-2-7-12(17)15-11-6-4-5-10-9-14-16-13(10)11/h4-6,9H,2-3,7-8H2,1H3,(H,14,16)(H,15,17)
InChIKeyKQEZZUALGQCLPR-UHFFFAOYSA-N
XLogP2.32
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1H-indazol-7-yl)butanamide
CID 36575526
4-(4-ethoxyphenoxy)-N-(1H-indazol-7-yl)butanamide
CID 34149775
4-hydroxy-N-(1H-indazol-7-yl)pentanamide
CID 79200987
2-amino-N-(1H-indazol-7-yl)-4-methoxybutanamide
CID 55081109
2-amino-N-(1H-indazol-7-yl)-3-methoxypropanamide
CID 81082479
3-(5-ethylfuran-2-yl)-N-(1H-indazol-7-yl)propanamide
CID 126421502
2-cyano-N-(1H-indazol-7-yl)acetamide
CID 110470078
4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(1H-indazol-7-yl)butanamide
CID 55547797
trans-(1R,2R)-N-[3-(1H-indazol-7-ylamino)-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 38015553
cis-(1R,2S)-N-[3-(1H-indazol-7-ylamino)-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 38015559
ethyl 2-(1H-indazol-7-ylamino)-2-oxoacetate
CID 110471105
N-(1H-indazol-7-yl)-2-methylpropanamide
CID 31817153

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-7-yl)-5-methoxypentanamide?
The IUPAC name of N-(1H-indazol-7-yl)-5-methoxypentanamide (CID 86871615) is N-(1H-indazol-7-yl)-5-methoxypentanamide.
What is the SMILES notation for N-(1H-indazol-7-yl)-5-methoxypentanamide?
The canonical SMILES for N-(1H-indazol-7-yl)-5-methoxypentanamide is COCCCCC(=O)Nc1cccc2cn[nH]c12.
What is the InChIKey of N-(1H-indazol-7-yl)-5-methoxypentanamide?
The InChIKey is KQEZZUALGQCLPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-18-8-3-2-7-12(17)15-11-6-4-5-10-9-14-16-13(10)11/h4-6,9H,2-3,7-8H2,1H3,(H,14,16)(H,15,17).
What are the key properties of N-(1H-indazol-7-yl)-5-methoxypentanamide?
N-(1H-indazol-7-yl)-5-methoxypentanamide has a molecular weight of 247.30 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-7-yl)-5-methoxypentanamide is sourced from PubChem (CID 86871615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).