3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine

C9H10IN — CID 146590185

IUPAC3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine
SMILESCC1Cc2cnc(I)cc2C1
InChIInChI=1S/C9H10IN/c1-6-2-7-4-9(10)11-5-8(7)3-6/h4-6H,2-3H2,1H3
InChIKeyTTXDGZKEDVBFAP-UHFFFAOYSA-N
MW259.09 g/mol
LogP2.42
Rot. Bonds

About 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine

3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine (PubChem CID 146590185) has the molecular formula C9H10IN and a molecular weight of 259.09 g/mol. Its IUPAC name is 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine.

Molecular Properties

Compound Name3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine
PubChem CID146590185
Molecular FormulaC9H10IN
Molecular Weight259.09 g/mol
Exact Mass258.99
IUPAC Name3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine
SMILESCC1Cc2cnc(I)cc2C1
InChIInChI=1S/C9H10IN/c1-6-2-7-4-9(10)11-5-8(7)3-6/h4-6H,2-3H2,1H3
InChIKeyTTXDGZKEDVBFAP-UHFFFAOYSA-N
XLogP2.42
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.09
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(7R)-7-methyl-5,6,7,8-tetrahydroisoquinolin-3-amine
CID 132548187
3-fluoro-6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 177053588
methane;2-methyl-2,3-dihydro-1H-indene
CID 142040721
ethane;6-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 90875415
(3S)-7-chloro-3-methyl-1,2,3,4-tetrahydro-2,6-naphthyridine
CID 163219599
(3S)-6-bromo-3-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine
CID 51893478
3-(4-chlorophenyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-6-amine
CID 115045453
3-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridine-6-carboxylic acid
CID 115024064
6,7-dichloro-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 150751811
1-(2-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol
CID 117281200
6-methyl-3-nitroso-5,6,7,8-tetrahydroquinoline
CID 176972000
3-cyclobutyl-6,7-dihydro-5H-cyclopenta[c]pyridin-6-amine
CID 115017606

Frequently Asked Questions

What is the IUPAC name of 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine?
The IUPAC name of 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine (CID 146590185) is 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine.
What is the SMILES notation for 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine?
The canonical SMILES for 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine is CC1Cc2cnc(I)cc2C1.
What is the InChIKey of 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine?
The InChIKey is TTXDGZKEDVBFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10IN/c1-6-2-7-4-9(10)11-5-8(7)3-6/h4-6H,2-3H2,1H3.
What are the key properties of 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine?
3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine has a molecular weight of 259.09 g/mol, XLogP of 2.42, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-6-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine is sourced from PubChem (CID 146590185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).