6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one

C14H17ClN2O — CID 64502307

IUPAC6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one
SMILESCC1CCC(Nc2cc3c(cc2Cl)NC(=O)C3)C1
InChIInChI=1S/C14H17ClN2O/c1-8-2-3-10(4-8)16-13-5-9-6-14(18)17-12(9)7-11(13)15/h5,7-8,10,16H,2-4,6H2,1H3,(H,17,18)
InChIKeyUDFPSJOSKQRBCQ-UHFFFAOYSA-N
MW264.76 g/mol
LogP3.44
Rot. Bonds2

About 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one

6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one (PubChem CID 64502307) has the molecular formula C14H17ClN2O and a molecular weight of 264.76 g/mol. Its IUPAC name is 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one
PubChem CID64502307
Molecular FormulaC14H17ClN2O
Molecular Weight264.76 g/mol
Exact Mass264.10
IUPAC Name6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one
SMILESCC1CCC(Nc2cc3c(cc2Cl)NC(=O)C3)C1
InChIInChI=1S/C14H17ClN2O/c1-8-2-3-10(4-8)16-13-5-9-6-14(18)17-12(9)7-11(13)15/h5,7-8,10,16H,2-4,6H2,1H3,(H,17,18)
InChIKeyUDFPSJOSKQRBCQ-UHFFFAOYSA-N
XLogP3.44
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.76
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one?
The IUPAC name of 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one (CID 64502307) is 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one?
The canonical SMILES for 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one is CC1CCC(Nc2cc3c(cc2Cl)NC(=O)C3)C1.
What is the InChIKey of 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one?
The InChIKey is UDFPSJOSKQRBCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O/c1-8-2-3-10(4-8)16-13-5-9-6-14(18)17-12(9)7-11(13)15/h5,7-8,10,16H,2-4,6H2,1H3,(H,17,18).
What are the key properties of 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one?
6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one has a molecular weight of 264.76 g/mol, XLogP of 3.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one is sourced from PubChem (CID 64502307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).