N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine

C13H19N3 — CID 62252990

IUPACN-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCc1cccnc1NC1CC2CCC(C1)N2
InChIInChI=1S/C13H19N3/c1-9-3-2-6-14-13(9)16-12-7-10-4-5-11(8-12)15-10/h2-3,6,10-12,15H,4-5,7-8H2,1H3,(H,14,16)
InChIKeyGKXUCZZEZIGSFI-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.08
Rot. Bonds2

About N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine

N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 62252990) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID62252990
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC NameN-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCc1cccnc1NC1CC2CCC(C1)N2
InChIInChI=1S/C13H19N3/c1-9-3-2-6-14-13(9)16-12-7-10-4-5-11(8-12)15-10/h2-3,6,10-12,15H,4-5,7-8H2,1H3,(H,14,16)
InChIKeyGKXUCZZEZIGSFI-UHFFFAOYSA-N
XLogP2.08
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-5-methylpyridine
CID 15348
2-(Benzylamino)pyridine
CID 23362
2,2'-Dipyridylamine
CID 14547
1-(2-Pyridyl)piperazine
CID 94459
WZ 811
CID 11565518
2-Pyridinamine, 4-methyl-N-(phenylmethyl)-
CID 83053
Pyridine, 2-benzylamino-, hydrochloride
CID 2830234
2-(Piperazin-1-yl)pyridine-3-carbonitrile
CID 2737203
1-[3-(Trifluoromethyl)pyridin-2-yl]piperazine
CID 2777786
N-cyclohexyl-4-methylpyridin-2-amine
CID 2366458
Thiourea, N-(5-methyl-2-pyridinyl)-N'-(2-phenylethyl)-
CID 971434
4-Methyl-6-(2-(5-(3-(Methylamino)propyl)pyridin-3-Yl)ethyl)pyridin-2-Amine
CID 119081688

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine (CID 62252990) is N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine is Cc1cccnc1NC1CC2CCC(C1)N2.
What is the InChIKey of N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is GKXUCZZEZIGSFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-9-3-2-6-14-13(9)16-12-7-10-4-5-11(8-12)15-10/h2-3,6,10-12,15H,4-5,7-8H2,1H3,(H,14,16).
What are the key properties of N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine?
N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 217.32 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 62252990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).