N-(1H-indazol-4-yl)pentanamide

C12H15N3O — CID 110479421

IUPACN-(1H-indazol-4-yl)pentanamide
SMILESCCCCC(=O)Nc1cccc2[nH]ncc12
InChIInChI=1S/C12H15N3O/c1-2-3-7-12(16)14-10-5-4-6-11-9(10)8-13-15-11/h4-6,8H,2-3,7H2,1H3,(H,13,15)(H,14,16)
InChIKeyQMXUEGPHKWCSST-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.69
Rot. Bonds4

About N-(1H-indazol-4-yl)pentanamide

N-(1H-indazol-4-yl)pentanamide (PubChem CID 110479421) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is N-(1H-indazol-4-yl)pentanamide.

Molecular Properties

Compound NameN-(1H-indazol-4-yl)pentanamide
PubChem CID110479421
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC NameN-(1H-indazol-4-yl)pentanamide
SMILESCCCCC(=O)Nc1cccc2[nH]ncc12
InChIInChI=1S/C12H15N3O/c1-2-3-7-12(16)14-10-5-4-6-11-9(10)8-13-15-11/h4-6,8H,2-3,7H2,1H3,(H,13,15)(H,14,16)
InChIKeyQMXUEGPHKWCSST-UHFFFAOYSA-N
XLogP2.69
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-(1H-indazol-4-ylamino)-6-oxohexanoic acid
CID 54866853
4-chloro-N-(1H-indazol-4-yl)butanamide
CID 63307555
N-(1H-indazol-4-yl)propanamide
CID 61035756
3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide
CID 110481555
3-(tert-butylamino)-N-(1H-indazol-4-yl)propanamide
CID 54863202
2-(dimethylamino)-N-(1H-indazol-4-yl)acetamide
CID 110479732
(E)-N-(1H-indazol-4-yl)but-2-enamide
CID 110470186
N-naphthalen-1-yldodecanamide
CID 588517
2-(2-aminophenyl)-N-(1H-indazol-4-yl)acetamide
CID 61117193
N-(1H-indazol-7-yl)butanamide
CID 36575526
1-[2-(1H-indazol-4-ylamino)-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 60933243
3-bromo-N-(1H-indazol-4-yl)prop-2-ynamide
CID 130664762

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-4-yl)pentanamide?
The IUPAC name of N-(1H-indazol-4-yl)pentanamide (CID 110479421) is N-(1H-indazol-4-yl)pentanamide.
What is the SMILES notation for N-(1H-indazol-4-yl)pentanamide?
The canonical SMILES for N-(1H-indazol-4-yl)pentanamide is CCCCC(=O)Nc1cccc2[nH]ncc12.
What is the InChIKey of N-(1H-indazol-4-yl)pentanamide?
The InChIKey is QMXUEGPHKWCSST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-2-3-7-12(16)14-10-5-4-6-11-9(10)8-13-15-11/h4-6,8H,2-3,7H2,1H3,(H,13,15)(H,14,16).
What are the key properties of N-(1H-indazol-4-yl)pentanamide?
N-(1H-indazol-4-yl)pentanamide has a molecular weight of 217.27 g/mol, XLogP of 2.69, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-4-yl)pentanamide is sourced from PubChem (CID 110479421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).