8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol

C16H25N3O — CID 115939641

IUPAC8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol
SMILESCCC(NC)c1ccc(N2C3CCC2CC(O)C3)cn1
InChIInChI=1S/C16H25N3O/c1-3-15(17-2)16-7-6-13(10-18-16)19-11-4-5-12(19)9-14(20)8-11/h6-7,10-12,14-15,17,20H,3-5,8-9H2,1-2H3
InChIKeyQSNAUZKXXHNABU-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.24
Rot. Bonds4

About 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol

8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 115939641) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID115939641
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol
SMILESCCC(NC)c1ccc(N2C3CCC2CC(O)C3)cn1
InChIInChI=1S/C16H25N3O/c1-3-15(17-2)16-7-6-13(10-18-16)19-11-4-5-12(19)9-14(20)8-11/h6-7,10-12,14-15,17,20H,3-5,8-9H2,1-2H3
InChIKeyQSNAUZKXXHNABU-UHFFFAOYSA-N
XLogP2.24
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol 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

2-(1-isobutyl-4-{[1-(3-pyridinyl)-1H-pyrrol-2-yl]methyl}-2-piperazinyl)ethanol
CID 16189848
2-(1-isopropyl-4-{[1-(3-pyridinyl)-1H-pyrrol-2-yl]methyl}-2-piperazinyl)ethanol
CID 16192159
(2S)-1-[[(1S,2S)-2-(3-methoxy-8-azabicyclo[3.2.1]octan-8-yl)-1,2-dipyridin-2-ylethyl]-(2-methoxyethyl)amino]propan-2-ol
CID 155537210
3-Amino-3-(pyridin-2-yl)propan-1-ol
CID 55292096
2-(5-Aminopyridin-2-yl)ethan-1-ol
CID 57886693
3-Cyclohexyl-3-[(5-methyl-2-pyridinyl)methylamino]propan-1-ol
CID 84595291
3-((1-(Pyridin-2-yl)ethyl)amino)propan-1-ol
CID 2772086
3-Amino-3-(5-fluoropyridin-2-yl)propan-1-ol
CID 55294031
(2S,3R)-3-amino-4-(2-fluorophenyl)-1-(3-pyrrolidin-1-yl-2-pyridinyl)butan-2-ol
CID 69120873
1-(6-Ethyl-5-fluoro-3-pyridinyl)piperidin-4-ol
CID 130244861
1,2-Dimethylpiperidin-4-ol;3-pyrrolidin-1-yl-2-(trifluoromethyl)pyridine
CID 155721068
(3R,4S)-1-(6-ethyl-3-pyridinyl)-3-fluoropiperidin-4-ol
CID 156166570

Frequently Asked Questions

What is the IUPAC name of 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol?
The IUPAC name of 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol (CID 115939641) is 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol.
What is the SMILES notation for 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol?
The canonical SMILES for 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol is CCC(NC)c1ccc(N2C3CCC2CC(O)C3)cn1.
What is the InChIKey of 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol?
The InChIKey is QSNAUZKXXHNABU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-15(17-2)16-7-6-13(10-18-16)19-11-4-5-12(19)9-14(20)8-11/h6-7,10-12,14-15,17,20H,3-5,8-9H2,1-2H3.
What are the key properties of 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol?
8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 275.40 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[6-[1-(methylamino)propyl]-3-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 115939641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).