cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone

C12H16N2O — CID 112535762

IUPACcyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone
SMILESCn1ccc2c1CCN(C(=O)C1CC1)C2
InChIInChI=1S/C12H16N2O/c1-13-6-4-10-8-14(7-5-11(10)13)12(15)9-2-3-9/h4,6,9H,2-3,5,7-8H2,1H3
InChIKeyJBOKKGXENARMJE-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.32
Rot. Bonds1

About cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone

cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone (PubChem CID 112535762) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone.

Molecular Properties

Compound Namecyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone
PubChem CID112535762
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Namecyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone
SMILESCn1ccc2c1CCN(C(=O)C1CC1)C2
InChIInChI=1S/C12H16N2O/c1-13-6-4-10-8-14(7-5-11(10)13)12(15)9-2-3-9/h4,6,9H,2-3,5,7-8H2,1H3
InChIKeyJBOKKGXENARMJE-UHFFFAOYSA-N
XLogP1.32
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone 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

3-methyl-1-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)butan-1-one
CID 112535720
1-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)-2-phenylethanone
CID 112535743
cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
CID 110872601
1-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)-2-pyridin-3-ylethanone
CID 112535716
(3-chlorophenyl)-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone
CID 112535736
2-(cyclopropanecarbonyl)-N,N-dimethyl-3,4-dihydro-1H-isoquinoline-7-sulfonamide
CID 110644359
1-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-yl]ethanone
CID 17127006
3-(4-methoxyphenyl)-1-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)propan-1-one
CID 112535781
(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(trifluoromethyl)cyclohexyl]methanone
CID 146127042
4-(7-fluoro-3,4-dihydro-1H-isoquinoline-2-carbonyl)cyclohexane-1-carboxylic acid
CID 120674494
N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclopropanecarboxamide
CID 16943500
cyclohexyl-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-yl]methanone
CID 38382766

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone?
The IUPAC name of cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone (CID 112535762) is cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone.
What is the SMILES notation for cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone?
The canonical SMILES for cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone is Cn1ccc2c1CCN(C(=O)C1CC1)C2.
What is the InChIKey of cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone?
The InChIKey is JBOKKGXENARMJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-13-6-4-10-8-14(7-5-11(10)13)12(15)9-2-3-9/h4,6,9H,2-3,5,7-8H2,1H3.
What are the key properties of cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone?
cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone has a molecular weight of 204.27 g/mol, XLogP of 1.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(1-methyl-6,7-dihydro-4H-pyrrolo[3,2-c]pyridin-5-yl)methanone is sourced from PubChem (CID 112535762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).