2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide

C15H22N4O — CID 65471480

IUPAC2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide
SMILESCN1C2CCCC1CC(NC(=O)c1cccnc1N)C2
InChIInChI=1S/C15H22N4O/c1-19-11-4-2-5-12(19)9-10(8-11)18-15(20)13-6-3-7-17-14(13)16/h3,6-7,10-12H,2,4-5,8-9H2,1H3,(H2,16,17)(H,18,20)
InChIKeyXIGVBMNQJFMNGL-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.41
Rot. Bonds2

About 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide

2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide (PubChem CID 65471480) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide
PubChem CID65471480
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide
SMILESCN1C2CCCC1CC(NC(=O)c1cccnc1N)C2
InChIInChI=1S/C15H22N4O/c1-19-11-4-2-5-12(19)9-10(8-11)18-15(20)13-6-3-7-17-14(13)16/h3,6-7,10-12H,2,4-5,8-9H2,1H3,(H2,16,17)(H,18,20)
InChIKeyXIGVBMNQJFMNGL-UHFFFAOYSA-N
XLogP1.41
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-1,3-benzoxazole-4-carboxamide
CID 91394528
5-amino-2-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)benzamide;dihydrochloride
CID 120647242
N-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 11231449
3-hydrazinyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-4-carboxamide
CID 105072265
2-amino-4-bromo-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)benzamide
CID 79706556
2-amino-N-(2-methylcyclohexyl)pyridine-3-carboxamide
CID 53334696
2-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-3-carboxamide
CID 103968313
2-amino-N-(2-methoxycyclopentyl)pyridine-3-carboxamide
CID 55069206
N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)-1,3-benzoxazole-4-carboxamide;hydrochloride
CID 66873673
3-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)thiophene-2-carboxamide
CID 65472913
2-(cyclohexylamino)-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-1,3-benzoxazole-4-carboxamide;hydrochloride
CID 66874447
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridine-3-carboxamide
CID 126842479

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide (CID 65471480) is 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide is CN1C2CCCC1CC(NC(=O)c1cccnc1N)C2.
What is the InChIKey of 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide?
The InChIKey is XIGVBMNQJFMNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-19-11-4-2-5-12(19)9-10(8-11)18-15(20)13-6-3-7-17-14(13)16/h3,6-7,10-12H,2,4-5,8-9H2,1H3,(H2,16,17)(H,18,20).
What are the key properties of 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide?
2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide has a molecular weight of 274.37 g/mol, XLogP of 1.41, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 65471480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).