N-(1H-indazol-5-ylmethyl)propanamide

C11H13N3O — CID 165111571

IUPACN-(1H-indazol-5-ylmethyl)propanamide
SMILESCCC(=O)NCc1ccc2[nH]ncc2c1
InChIInChI=1S/C11H13N3O/c1-2-11(15)12-6-8-3-4-10-9(5-8)7-13-14-10/h3-5,7H,2,6H2,1H3,(H,12,15)(H,13,14)
InChIKeyQYEZEWINHDDRMN-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.59
Rot. Bonds3

About N-(1H-indazol-5-ylmethyl)propanamide

N-(1H-indazol-5-ylmethyl)propanamide (PubChem CID 165111571) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is N-(1H-indazol-5-ylmethyl)propanamide.

Molecular Properties

Compound NameN-(1H-indazol-5-ylmethyl)propanamide
PubChem CID165111571
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC NameN-(1H-indazol-5-ylmethyl)propanamide
SMILESCCC(=O)NCc1ccc2[nH]ncc2c1
InChIInChI=1S/C11H13N3O/c1-2-11(15)12-6-8-3-4-10-9(5-8)7-13-14-10/h3-5,7H,2,6H2,1H3,(H,12,15)(H,13,14)
InChIKeyQYEZEWINHDDRMN-UHFFFAOYSA-N
XLogP1.59
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(5Z,8Z,11Z,14Z)-N-(1H-indazol-5-ylmethyl)icosa-5,8,11,14-tetraenamide
CID 130453312
tert-butyl N-(1H-indazol-5-ylmethyl)carbamate
CID 59462463
2-chloro-N-[2-(1H-indazol-5-yl)ethyl]acetamide
CID 154880645
2-(1H-indazol-5-yl)acetic acid
CID 39103838
N-(1H-indazol-6-ylmethyl)-2-phenylacetamide
CID 110472122
N-[(4-tert-butylphenyl)methyl]-1H-indazole-5-carboxamide
CID 22933798
N-(1H-indazol-6-ylmethyl)-2,2-dimethylpropanamide
CID 110470760
2-[5-(4-chloro-3-fluorophenyl)-2-ethyl-1,2,4-triazol-3-yl]-N-(1H-indazol-5-ylmethyl)acetamide
CID 155789579
N-(1H-indazol-5-ylmethyl)-8-(methyldisulfanyl)quinoline-5-carboxamide
CID 74762755
N-(3,4-dimethylphenyl)-1-[2-(1H-indazol-5-ylmethylamino)-2-oxoethyl]-1,2,4-triazole-3-carboxamide
CID 162657007
N-[[3-(1H-pyrazol-4-yl)phenyl]methyl]propanamide
CID 66854523
5-dodecyl-1H-indazole
CID 67799721

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-5-ylmethyl)propanamide?
The IUPAC name of N-(1H-indazol-5-ylmethyl)propanamide (CID 165111571) is N-(1H-indazol-5-ylmethyl)propanamide.
What is the SMILES notation for N-(1H-indazol-5-ylmethyl)propanamide?
The canonical SMILES for N-(1H-indazol-5-ylmethyl)propanamide is CCC(=O)NCc1ccc2[nH]ncc2c1.
What is the InChIKey of N-(1H-indazol-5-ylmethyl)propanamide?
The InChIKey is QYEZEWINHDDRMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-2-11(15)12-6-8-3-4-10-9(5-8)7-13-14-10/h3-5,7H,2,6H2,1H3,(H,12,15)(H,13,14).
What are the key properties of N-(1H-indazol-5-ylmethyl)propanamide?
N-(1H-indazol-5-ylmethyl)propanamide has a molecular weight of 203.24 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-5-ylmethyl)propanamide is sourced from PubChem (CID 165111571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).