N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide

C14H18N4O — CID 116652054

IUPACN-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide
SMILESCN(C(=O)c1n[nH]c2ccccc12)C(CN)C1CC1
InChIInChI=1S/C14H18N4O/c1-18(12(8-15)9-6-7-9)14(19)13-10-4-2-3-5-11(10)16-17-13/h2-5,9,12H,6-8,15H2,1H3,(H,16,17)
InChIKeyNEBWZRZVJULEIN-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.37
Rot. Bonds4

About N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide

N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide (PubChem CID 116652054) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide
PubChem CID116652054
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide
SMILESCN(C(=O)c1n[nH]c2ccccc12)C(CN)C1CC1
InChIInChI=1S/C14H18N4O/c1-18(12(8-15)9-6-7-9)14(19)13-10-4-2-3-5-11(10)16-17-13/h2-5,9,12H,6-8,15H2,1H3,(H,16,17)
InChIKeyNEBWZRZVJULEIN-UHFFFAOYSA-N
XLogP1.37
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(2-amino-1-cyclohexylethyl)-1H-indazole-3-carboxamide;hydrochloride
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3-[1H-indazole-3-carbonyl(methyl)amino]-2-methylpropanoic acid
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N-(2-amino-2-oxoethyl)-N-propan-2-yl-1H-indazole-3-carboxamide
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ethane;N-methoxy-N-methyl-1H-indazole-3-carboxamide
CID 142077122
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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide (CID 116652054) is N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide is CN(C(=O)c1n[nH]c2ccccc12)C(CN)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide?
The InChIKey is NEBWZRZVJULEIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-18(12(8-15)9-6-7-9)14(19)13-10-4-2-3-5-11(10)16-17-13/h2-5,9,12H,6-8,15H2,1H3,(H,16,17).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide?
N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide is sourced from PubChem (CID 116652054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).