cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone

C11H15N3O — CID 110872601

IUPACcyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
SMILESCn1cnc2c1CN(C(=O)C1CC1)CC2
InChIInChI=1S/C11H15N3O/c1-13-7-12-9-4-5-14(6-10(9)13)11(15)8-2-3-8/h7-8H,2-6H2,1H3
InChIKeyILXBRTKBYDDJBA-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.71
Rot. Bonds1

About cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone

cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone (PubChem CID 110872601) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone.

Molecular Properties

Compound Namecyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
PubChem CID110872601
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Namecyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
SMILESCn1cnc2c1CN(C(=O)C1CC1)CC2
InChIInChI=1S/C11H15N3O/c1-13-7-12-9-4-5-14(6-10(9)13)11(15)8-2-3-8/h7-8H,2-6H2,1H3
InChIKeyILXBRTKBYDDJBA-UHFFFAOYSA-N
XLogP0.71
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone?
The IUPAC name of cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone (CID 110872601) is cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone.
What is the SMILES notation for cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone?
The canonical SMILES for cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone is Cn1cnc2c1CN(C(=O)C1CC1)CC2.
What is the InChIKey of cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone?
The InChIKey is ILXBRTKBYDDJBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-13-7-12-9-4-5-14(6-10(9)13)11(15)8-2-3-8/h7-8H,2-6H2,1H3.
What are the key properties of cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone?
cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone has a molecular weight of 205.26 g/mol, XLogP of 0.71, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone is sourced from PubChem (CID 110872601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).