N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide

C17H24N4O — CID 119590893

IUPACN-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide
SMILESNCC(NC(=O)Cc1[nH]nc2ccccc12)C1CCCCC1
InChIInChI=1S/C17H24N4O/c18-11-16(12-6-2-1-3-7-12)19-17(22)10-15-13-8-4-5-9-14(13)20-21-15/h4-5,8-9,12,16H,1-3,6-7,10-11,18H2,(H,19,22)(H,20,21)
InChIKeyYNQOFNKVKPUZBA-UHFFFAOYSA-N
MW300.41 g/mol
LogP2.13
Rot. Bonds5

About N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide

N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide (PubChem CID 119590893) has the molecular formula C17H24N4O and a molecular weight of 300.41 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide
PubChem CID119590893
Molecular FormulaC17H24N4O
Molecular Weight300.41 g/mol
Exact Mass300.20
IUPAC NameN-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide
SMILESNCC(NC(=O)Cc1[nH]nc2ccccc12)C1CCCCC1
InChIInChI=1S/C17H24N4O/c18-11-16(12-6-2-1-3-7-12)19-17(22)10-15-13-8-4-5-9-14(13)20-21-15/h4-5,8-9,12,16H,1-3,6-7,10-11,18H2,(H,19,22)(H,20,21)
InChIKeyYNQOFNKVKPUZBA-UHFFFAOYSA-N
XLogP2.13
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide
CID 119615735
N-(2-amino-1-cyclohexylethyl)-2-naphthalen-1-ylacetamide
CID 119591137
N-(2-amino-1-cyclohexylethyl)-1H-indazole-3-carboxamide;hydrochloride
CID 119591831
N-(2-amino-1-cyclopentylethyl)-1H-indazole-3-carboxamide
CID 106737709
N-(2-amino-1-cyclohexylethyl)-4-oxo-3H-phthalazine-1-carboxamide
CID 119591824
N-(2-amino-1-cyclohexylethyl)-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide;hydrochloride
CID 119590714
N-(2-amino-1-cyclohexylethyl)-3-phenylpropanamide;hydrochloride
CID 119260925
N-(2-aminoethyl)-2-(2H-indazol-3-yl)acetamide;hydrochloride
CID 119384110
N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide
CID 154735944
2-(2H-indazol-3-yl)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120574124
N-[(1R)-2-amino-1-cyclohexylethyl]-2-indazol-2-ylacetamide
CID 170897061
N-[(1R)-2-amino-1-cyclohexylethyl]-2-indazol-2-ylacetamide;dihydrochloride
CID 170897060

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide (CID 119590893) is N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide is NCC(NC(=O)Cc1[nH]nc2ccccc12)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide?
The InChIKey is YNQOFNKVKPUZBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O/c18-11-16(12-6-2-1-3-7-12)19-17(22)10-15-13-8-4-5-9-14(13)20-21-15/h4-5,8-9,12,16H,1-3,6-7,10-11,18H2,(H,19,22)(H,20,21).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide?
N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide has a molecular weight of 300.41 g/mol, XLogP of 2.13, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide is sourced from PubChem (CID 119590893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).