2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane

C10H15N3 — CID 91260051

IUPAC2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane
SMILESCc1ncc(C2CC3CCC2N3)[nH]1
InChIInChI=1S/C10H15N3/c1-6-11-5-10(12-6)8-4-7-2-3-9(8)13-7/h5,7-9,13H,2-4H2,1H3,(H,11,12)
InChIKeyHFAFRSGBFDLTFM-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.33
Rot. Bonds1

About 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane

2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane (PubChem CID 91260051) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane.

Molecular Properties

Compound Name2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane
PubChem CID91260051
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane
SMILESCc1ncc(C2CC3CCC2N3)[nH]1
InChIInChI=1S/C10H15N3/c1-6-11-5-10(12-6)8-4-7-2-3-9(8)13-7/h5,7-9,13H,2-4H2,1H3,(H,11,12)
InChIKeyHFAFRSGBFDLTFM-UHFFFAOYSA-N
XLogP1.33
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane 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-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine
CID 90202035
(1R,2R,4S)-2-(6-chloro-3-pyridinyl)-7-azabicyclo[2.2.1]heptane
CID 854023
(1R,2S)-2-(6-chloro-3-pyridinyl)-7-azabicyclo[2.2.1]heptane
CID 10081807
(1S,2R,4R)-2-(6-chloro-3-pyridinyl)-7-azabicyclo[2.2.1]heptane
CID 11031065
2-methyl-5-(4-methylcyclohexyl)-1H-imidazole
CID 90181976
(1R,2R,4S)-2-pyridazin-4-yl-7-azabicyclo[2.2.1]heptane
CID 10487486
(1R,2R,4S)-2-(5,6-difluoro-3-pyridinyl)-7-azabicyclo[2.2.1]heptane
CID 11830689
4-(2-methyl-1H-imidazol-5-yl)cyclohexane-1-thiol
CID 144689956
(2S)-2-phenyl-7-azabicyclo[2.2.1]heptane
CID 10197910
5-(7-azabicyclo[2.2.1]heptan-2-yl)pyridine-2-carbonitrile
CID 89127055
(1R,2R,4S)-2-(5-chloro-3-pyridinyl)-7-azabicyclo[2.2.1]heptane
CID 11369535
ethane;1-methyl-4-(2-methyl-1H-imidazol-5-yl)piperidine
CID 144594096

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane?
The IUPAC name of 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane (CID 91260051) is 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane.
What is the SMILES notation for 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane?
The canonical SMILES for 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane is Cc1ncc(C2CC3CCC2N3)[nH]1.
What is the InChIKey of 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane?
The InChIKey is HFAFRSGBFDLTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-6-11-5-10(12-6)8-4-7-2-3-9(8)13-7/h5,7-9,13H,2-4H2,1H3,(H,11,12).
What are the key properties of 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane?
2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane has a molecular weight of 177.25 g/mol, XLogP of 1.33, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1H-imidazol-5-yl)-7-azabicyclo[2.2.1]heptane is sourced from PubChem (CID 91260051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).