N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide

C17H22N4O — CID 11630786

IUPACN-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide
SMILESCN(C(=O)c1n[nH]c2ccccc12)C1CC2CCC(C1)N2C
InChIInChI=1S/C17H22N4O/c1-20-11-7-8-12(20)10-13(9-11)21(2)17(22)16-14-5-3-4-6-15(14)18-19-16/h3-6,11-13H,7-10H2,1-2H3,(H,18,19)
InChIKeyAKHPDZHVFVVQHV-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.26
Rot. Bonds2

About N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide

N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide (PubChem CID 11630786) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide
PubChem CID11630786
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC NameN-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide
SMILESCN(C(=O)c1n[nH]c2ccccc12)C1CC2CCC(C1)N2C
InChIInChI=1S/C17H22N4O/c1-20-11-7-8-12(20)10-13(9-11)21(2)17(22)16-14-5-3-4-6-15(14)18-19-16/h3-6,11-13H,7-10H2,1-2H3,(H,18,19)
InChIKeyAKHPDZHVFVVQHV-UHFFFAOYSA-N
XLogP2.26
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-N-methyl-N-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-1H-indazole-3-carboxamide
CID 67274033
N-(furan-2-yl)-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide
CID 68618356
1H-indazole-3-carboxamide;(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane
CID 67338966
N-methyl-N-[1-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)azetidin-3-yl]-1H-indazole-3-carboxamide
CID 126921173
N-(2-amino-1-cyclopropylethyl)-N-methyl-1H-indazole-3-carboxamide
CID 116652054
1H-indazol-3-yl-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)methanone
CID 11681223
N-[[(2S,5R)-5-[2-(dimethylamino)-2-oxoethyl]-1-methylpyrrolidin-2-yl]methyl]-1H-indazole-3-carboxamide
CID 110134597
N-[(1R,2R,3R)-2-hydroxy-3-methoxycyclohexyl]-N-methyl-1H-indazole-3-carboxamide
CID 110125701
N-ethyl-N-piperidin-4-yl-1H-indazole-3-carboxamide
CID 60805904
1H-indazol-3-yl-(5-methyl-2,5-diazabicyclo[2.2.2]octan-2-yl)methanone
CID 59749066
N,5-dimethyl-N-(1-oxothian-4-yl)-1H-indazole-3-carboxamide
CID 75535689
N-butan-2-yl-N-[(5R)-9-butyl-3-oxa-9-azabicyclo[3.3.1]nonan-7-yl]-1H-indazole-3-carboxamide
CID 67673217

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide?
The IUPAC name of N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide (CID 11630786) is N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide is CN(C(=O)c1n[nH]c2ccccc12)C1CC2CCC(C1)N2C.
What is the InChIKey of N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide?
The InChIKey is AKHPDZHVFVVQHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O/c1-20-11-7-8-12(20)10-13(9-11)21(2)17(22)16-14-5-3-4-6-15(14)18-19-16/h3-6,11-13H,7-10H2,1-2H3,(H,18,19).
What are the key properties of N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide?
N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide has a molecular weight of 298.39 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 11630786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).