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

C12H13N3O2 — CID 71836377

IUPACfuran-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
SMILESCn1cnc2c1CN(C(=O)c1ccoc1)CC2
InChIInChI=1S/C12H13N3O2/c1-14-8-13-10-2-4-15(6-11(10)14)12(16)9-3-5-17-7-9/h3,5,7-8H,2,4,6H2,1H3
InChIKeyRTFYLUZQGDUETD-UHFFFAOYSA-N
MW231.25 g/mol
LogP1.21
Rot. Bonds1

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

furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone (PubChem CID 71836377) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone.

Molecular Properties

Compound Namefuran-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
PubChem CID71836377
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Namefuran-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
SMILESCn1cnc2c1CN(C(=O)c1ccoc1)CC2
InChIInChI=1S/C12H13N3O2/c1-14-8-13-10-2-4-15(6-11(10)14)12(16)9-3-5-17-7-9/h3,5,7-8H,2,4,6H2,1H3
InChIKeyRTFYLUZQGDUETD-UHFFFAOYSA-N
XLogP1.21
TPSA51.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Furan-3-yl-(4-methyl-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-7-yl)methanone
CID 97381248
[1-(cyclopropylmethoxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(furan-3-yl)methanone
CID 97405977
[1-(cyclopropylmethoxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(2-methylfuran-3-yl)methanone
CID 97405982
furan-3-yl-[3-[(4-methylpiperazin-1-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 97406822
[1-(ethoxymethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-(furan-3-yl)methanone
CID 97520218
furan-3-yl-[8-methyl-3-(oxan-4-ylmethoxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 118739001
5-(furan-3-ylmethyl)-1-methyl-7-(2-methylpropoxymethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 118739313
1-(cyclopropylmethyl)-7-(ethoxymethyl)-5-(furan-3-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 118739773
[3-(ethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(2-methylfuran-3-yl)methanone
CID 118740883
[4-(ethoxymethyl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]-(furan-3-yl)methanone
CID 118740887
furan-3-yl-[1-methyl-7-(oxan-4-ylmethoxymethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]methanone
CID 118741167
2-[[5-(furan-3-ylmethyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]-N,N-dimethylacetamide
CID 118746025

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone?
The IUPAC name of furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone (CID 71836377) is furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone.
What is the SMILES notation for furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone?
The canonical SMILES for furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone is Cn1cnc2c1CN(C(=O)c1ccoc1)CC2.
What is the InChIKey of furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone?
The InChIKey is RTFYLUZQGDUETD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c1-14-8-13-10-2-4-15(6-11(10)14)12(16)9-3-5-17-7-9/h3,5,7-8H,2,4,6H2,1H3.
What are the key properties of furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone?
furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone has a molecular weight of 231.25 g/mol, XLogP of 1.21, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone is sourced from PubChem (CID 71836377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).