2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide

C17H21N5O — CID 118772312

IUPAC2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
SMILESCC(C)C(NC(=O)Cc1[nH]nc2ccccc12)c1nccn1C
InChIInChI=1S/C17H21N5O/c1-11(2)16(17-18-8-9-22(17)3)19-15(23)10-14-12-6-4-5-7-13(12)20-21-14/h4-9,11,16H,10H2,1-3H3,(H,19,23)(H,20,21)
InChIKeyZOMZABHTAVKZHY-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.35
Rot. Bonds5

About 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide

2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide (PubChem CID 118772312) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide.

Molecular Properties

Compound Name2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
PubChem CID118772312
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC Name2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
SMILESCC(C)C(NC(=O)Cc1[nH]nc2ccccc12)c1nccn1C
InChIInChI=1S/C17H21N5O/c1-11(2)16(17-18-8-9-22(17)3)19-15(23)10-14-12-6-4-5-7-13(12)20-21-14/h4-9,11,16H,10H2,1-3H3,(H,19,23)(H,20,21)
InChIKeyZOMZABHTAVKZHY-UHFFFAOYSA-N
XLogP2.35
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-[[2-(2H-indazol-3-yl)acetyl]amino]-3-methylbutanoic acid
CID 119369285
2-(3-methoxyphenyl)-N-[(1R)-2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
CID 125164841
(2R)-2-[[2-(2H-indazol-3-yl)acetyl]amino]-3-methylsulfanylpropanoic acid
CID 121494637
N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-2-(5-oxo-2-phenylcyclopenten-1-yl)acetamide
CID 118779912
2-(2-methoxyethoxy)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
CID 118787632
N-[(1S)-2-methyl-1-(1-methylimidazol-2-yl)propyl]-5-(phenoxymethyl)-1H-pyrazole-3-carboxamide
CID 95197106
2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-[(1R)-2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
CID 125436681
2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
CID 122558009
N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(2H-indazol-3-yl)acetamide
CID 95189916
(2S)-2-[[2-[[2-(2H-indazol-3-yl)acetyl]amino]acetyl]amino]-4-methylpentanoic acid
CID 120695229
N-[(2R)-2-(ethylamino)propyl]-2-(2H-indazol-3-yl)acetamide;hydrochloride
CID 120652726
N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide
CID 119615735

Frequently Asked Questions

What is the IUPAC name of 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide?
The IUPAC name of 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide (CID 118772312) is 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide.
What is the SMILES notation for 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide?
The canonical SMILES for 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide is CC(C)C(NC(=O)Cc1[nH]nc2ccccc12)c1nccn1C.
What is the InChIKey of 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide?
The InChIKey is ZOMZABHTAVKZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O/c1-11(2)16(17-18-8-9-22(17)3)19-15(23)10-14-12-6-4-5-7-13(12)20-21-14/h4-9,11,16H,10H2,1-3H3,(H,19,23)(H,20,21).
What are the key properties of 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide?
2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide has a molecular weight of 311.39 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide is sourced from PubChem (CID 118772312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).