6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one

C15H18ClNO2 — CID 61082859

IUPAC6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(O)C3CCCCC3)c(Cl)cc2N1
InChIInChI=1S/C15H18ClNO2/c16-12-8-13-10(7-14(18)17-13)6-11(12)15(19)9-4-2-1-3-5-9/h6,8-9,15,19H,1-5,7H2,(H,17,18)
InChIKeyWFHDHBIISGWDHC-UHFFFAOYSA-N
MW279.77 g/mol
LogP3.45
Rot. Bonds2

About 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one

6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one (PubChem CID 61082859) has the molecular formula C15H18ClNO2 and a molecular weight of 279.77 g/mol. Its IUPAC name is 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one
PubChem CID61082859
Molecular FormulaC15H18ClNO2
Molecular Weight279.77 g/mol
Exact Mass279.10
IUPAC Name6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(C(O)C3CCCCC3)c(Cl)cc2N1
InChIInChI=1S/C15H18ClNO2/c16-12-8-13-10(7-14(18)17-13)6-11(12)15(19)9-4-2-1-3-5-9/h6,8-9,15,19H,1-5,7H2,(H,17,18)
InChIKeyWFHDHBIISGWDHC-UHFFFAOYSA-N
XLogP3.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.77
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one 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

6-chloro-5-[cyclopentyl(hydroxy)methyl]-1,3-dihydroindol-2-one
CID 61082264
6-chloro-5-[chloro(cyclohexyl)methyl]-1,3-dihydroindol-2-one
CID 61084046
6-chloro-5-[hydroxy(oxan-3-yl)methyl]-1,3-dihydroindol-2-one
CID 63013855
6-chloro-5-[hydroxy(piperidin-3-yl)methyl]-1,3-dihydroindol-2-one
CID 43457516
5-[amino(cyclohexyl)methyl]-6-chloro-1,3-dihydroindol-2-one
CID 43457574
6-chloro-5-(1-hydroxy-2-methylpropyl)-1,3-dihydroindol-2-one
CID 61081464
5-[(1S)-1-aminoethyl]-6-chloro-1,3-dihydroindol-2-one
CID 82758304
5-[bromo(oxan-3-yl)methyl]-6-chloro-1,3-dihydroindol-2-one
CID 63015097
6-chloro-5-(3,3,3-trifluoro-1-hydroxypropyl)-1,3-dihydroindol-2-one
CID 61082063
6-chloro-5-[2-(4-chlorophenyl)-1-hydroxyethyl]-1,3-dihydroindol-2-one
CID 61080710
6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one
CID 62633530
6-[cyclohexyl(hydroxy)methyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 61081459

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one?
The IUPAC name of 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one (CID 61082859) is 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one?
The canonical SMILES for 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one is O=C1Cc2cc(C(O)C3CCCCC3)c(Cl)cc2N1.
What is the InChIKey of 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one?
The InChIKey is WFHDHBIISGWDHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClNO2/c16-12-8-13-10(7-14(18)17-13)6-11(12)15(19)9-4-2-1-3-5-9/h6,8-9,15,19H,1-5,7H2,(H,17,18).
What are the key properties of 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one?
6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one has a molecular weight of 279.77 g/mol, XLogP of 3.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-[cyclohexyl(hydroxy)methyl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 61082859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).