2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide

C15H18N4O — CID 107842800

IUPAC2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide
SMILESCn1cc(C(N)C(=O)NC2Cc3ccccc3C2)cn1
InChIInChI=1S/C15H18N4O/c1-19-9-12(8-17-19)14(16)15(20)18-13-6-10-4-2-3-5-11(10)7-13/h2-5,8-9,13-14H,6-7,16H2,1H3,(H,18,20)
InChIKeyPTEHFTJUDMRXSD-UHFFFAOYSA-N
MW270.34 g/mol
LogP0.70
Rot. Bonds3

About 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide

2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide (PubChem CID 107842800) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide
PubChem CID107842800
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide
SMILESCn1cc(C(N)C(=O)NC2Cc3ccccc3C2)cn1
InChIInChI=1S/C15H18N4O/c1-19-9-12(8-17-19)14(16)15(20)18-13-6-10-4-2-3-5-11(10)7-13/h2-5,8-9,13-14H,6-7,16H2,1H3,(H,18,20)
InChIKeyPTEHFTJUDMRXSD-UHFFFAOYSA-N
XLogP0.70
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-(1-methylpyrazol-4-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 115290593
2-amino-2-(1-methylpyrazol-4-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 115290409
2-amino-N-(2-hydroxyphenyl)-2-(1-methylpyrazol-4-yl)acetamide
CID 115290771
2-amino-N-(1-ethylpiperidin-4-yl)-2-(1-methylpyrazol-4-yl)acetamide
CID 115290278
2-amino-N-(2,3-dihydro-1H-inden-2-yl)propanamide
CID 14599683
2-amino-N-[(1S)-1-(2-methylphenyl)ethyl]-2-(1-methylpyrazol-4-yl)acetamide
CID 115291040
2-amino-N-[(1R)-1-(2-chlorophenyl)ethyl]-2-(1-methylpyrazol-4-yl)acetamide
CID 115291042
2-amino-N-(2-methyl-2-phenylpropyl)-2-(1-methylpyrazol-4-yl)acetamide
CID 115290258
2-amino-2-(1-methylpyrazol-4-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 115289633
methyl 2-[[2-amino-2-(1-methylpyrazol-4-yl)acetyl]amino]benzoate
CID 115289802
2-[[2-amino-2-(1-methylpyrazol-4-yl)acetyl]amino]acetic acid
CID 115290299
N-(2-acetamidoethyl)-2-amino-2-(1-methylpyrazol-4-yl)acetamide
CID 113279811

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The IUPAC name of 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide (CID 107842800) is 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide is Cn1cc(C(N)C(=O)NC2Cc3ccccc3C2)cn1.
What is the InChIKey of 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The InChIKey is PTEHFTJUDMRXSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-19-9-12(8-17-19)14(16)15(20)18-13-6-10-4-2-3-5-11(10)7-13/h2-5,8-9,13-14H,6-7,16H2,1H3,(H,18,20).
What are the key properties of 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide?
2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide has a molecular weight of 270.34 g/mol, XLogP of 0.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-4-yl)acetamide is sourced from PubChem (CID 107842800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).