N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide

C17H20N6O — CID 154735944

IUPACN-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide
SMILESO=C(Cc1[nH]nc2ccccc12)Nc1ncn(C2CCCCC2)n1
InChIInChI=1S/C17H20N6O/c24-16(10-15-13-8-4-5-9-14(13)20-21-15)19-17-18-11-23(22-17)12-6-2-1-3-7-12/h4-5,8-9,11-12H,1-3,6-7,10H2,(H,20,21)(H,19,22,24)
InChIKeyPAIVURQEVVBTPN-UHFFFAOYSA-N
MW324.39 g/mol
LogP2.84
Rot. Bonds4

About N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide

N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide (PubChem CID 154735944) has the molecular formula C17H20N6O and a molecular weight of 324.39 g/mol. Its IUPAC name is N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide
PubChem CID154735944
Molecular FormulaC17H20N6O
Molecular Weight324.39 g/mol
Exact Mass324.17
IUPAC NameN-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide
SMILESO=C(Cc1[nH]nc2ccccc12)Nc1ncn(C2CCCCC2)n1
InChIInChI=1S/C17H20N6O/c24-16(10-15-13-8-4-5-9-14(13)20-21-15)19-17-18-11-23(22-17)12-6-2-1-3-7-12/h4-5,8-9,11-12H,1-3,6-7,10H2,(H,20,21)(H,19,22,24)
InChIKeyPAIVURQEVVBTPN-UHFFFAOYSA-N
XLogP2.84
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.39
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

formic acid;2-(2H-indazol-3-yl)-N-(1-propyl-1,2,4-triazol-3-yl)acetamide
CID 163340978
N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide
CID 119590893
N-(2H-indazol-3-ylmethyl)cyclohexanamine
CID 62310025
1-[[2-(2H-indazol-3-yl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 119168100
N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide
CID 119615735
2-(2H-indazol-3-yl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120574124
2-[3-[[2-(2H-indazol-3-yl)acetyl]amino]pyrazol-1-yl]-2-methylpropanoic acid
CID 154740868
2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide
CID 176503598
2-(2H-indazol-3-yl)-N-(2-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120601030
N-(2-aminoethyl)-2-(2H-indazol-3-yl)acetamide;hydrochloride
CID 119384110
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(2H-indazol-3-yl)acetamide;hydrochloride
CID 119574460
N-(1-cyclohexyl-1,2,4-triazol-3-yl)-3H-benzimidazole-5-carboxamide
CID 75520966

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide?
The IUPAC name of N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide (CID 154735944) is N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide.
What is the SMILES notation for N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide?
The canonical SMILES for N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide is O=C(Cc1[nH]nc2ccccc12)Nc1ncn(C2CCCCC2)n1.
What is the InChIKey of N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide?
The InChIKey is PAIVURQEVVBTPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O/c24-16(10-15-13-8-4-5-9-14(13)20-21-15)19-17-18-11-23(22-17)12-6-2-1-3-7-12/h4-5,8-9,11-12H,1-3,6-7,10H2,(H,20,21)(H,19,22,24).
What are the key properties of N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide?
N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide has a molecular weight of 324.39 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide is sourced from PubChem (CID 154735944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).