8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine

C14H21N3 — CID 43131751

IUPAC8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CCC1CC(NCc1cccnc1)C2
InChIInChI=1S/C14H21N3/c1-17-13-4-5-14(17)8-12(7-13)16-10-11-3-2-6-15-9-11/h2-3,6,9,12-14,16H,4-5,7-8,10H2,1H3
InChIKeyICMHXMJFPIFSGH-UHFFFAOYSA-N
MW231.34 g/mol
LogP1.80
Rot. Bonds3

About 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine

8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 43131751) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID43131751
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC Name8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CCC1CC(NCc1cccnc1)C2
InChIInChI=1S/C14H21N3/c1-17-13-4-5-14(17)8-12(7-13)16-10-11-3-2-6-15-9-11/h2-3,6,9,12-14,16H,4-5,7-8,10H2,1H3
InChIKeyICMHXMJFPIFSGH-UHFFFAOYSA-N
XLogP1.80
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N,3-N,5-N-tris(pyridin-3-ylmethyl)cyclohexane-1,3,5-triamine
CID 177421480
(1R,5R)-8-methyl-N-(pyridin-4-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 129374539
(1R,5S)-N-benzyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 750316
1-N,4-N-bis(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 139088209
N-(pyridin-3-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 112728477
N-[(3-ethoxyphenyl)methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 60873537
N-propyl-8-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 62740890
[1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-pyridin-3-ylethyl]hydrazine
CID 105265799
N-(pyridin-3-ylmethyl)thian-4-amine
CID 43394819
(3R)-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine;hydrochloride
CID 71636735
4,4-difluoro-N-(pyridin-3-ylmethyl)cyclohexan-1-amine
CID 126787190
3-(4-bromophenyl)-N-(pyridin-3-ylmethyl)cyclobutan-1-amine
CID 43634519

Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine (CID 43131751) is 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine is CN1C2CCC1CC(NCc1cccnc1)C2.
What is the InChIKey of 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is ICMHXMJFPIFSGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-17-13-4-5-14(17)8-12(7-13)16-10-11-3-2-6-15-9-11/h2-3,6,9,12-14,16H,4-5,7-8,10H2,1H3.
What are the key properties of 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine?
8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 231.34 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 43131751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).