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

C14H18N4O — CID 119615735

IUPACN-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide
SMILESNCC(NC(=O)Cc1[nH]nc2ccccc12)C1CC1
InChIInChI=1S/C14H18N4O/c15-8-13(9-5-6-9)16-14(19)7-12-10-3-1-2-4-11(10)17-18-12/h1-4,9,13H,5-8,15H2,(H,16,19)(H,17,18)
InChIKeyLGLPLVJBNNTJOE-UHFFFAOYSA-N
MW258.32 g/mol
LogP0.96
Rot. Bonds5

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

N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide (PubChem CID 119615735) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide
PubChem CID119615735
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide
SMILESNCC(NC(=O)Cc1[nH]nc2ccccc12)C1CC1
InChIInChI=1S/C14H18N4O/c15-8-13(9-5-6-9)16-14(19)7-12-10-3-1-2-4-11(10)17-18-12/h1-4,9,13H,5-8,15H2,(H,16,19)(H,17,18)
InChIKeyLGLPLVJBNNTJOE-UHFFFAOYSA-N
XLogP0.96
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 50.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide (CID 119615735) is N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide is NCC(NC(=O)Cc1[nH]nc2ccccc12)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide?
The InChIKey is LGLPLVJBNNTJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c15-8-13(9-5-6-9)16-14(19)7-12-10-3-1-2-4-11(10)17-18-12/h1-4,9,13H,5-8,15H2,(H,16,19)(H,17,18).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide?
N-(2-amino-1-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide has a molecular weight of 258.32 g/mol, XLogP of 0.96, 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-cyclopropylethyl)-2-(2H-indazol-3-yl)acetamide is sourced from PubChem (CID 119615735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).