6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide

C20H23N3O2 — CID 66673676

IUPAC6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(Oc2ccc3c(c2)CCC3NC2CCCC2)nc1
InChIInChI=1S/C20H23N3O2/c21-20(24)14-6-10-19(22-12-14)25-16-7-8-17-13(11-16)5-9-18(17)23-15-3-1-2-4-15/h6-8,10-12,15,18,23H,1-5,9H2,(H2,21,24)
InChIKeyPOVPPLVXXOUPMX-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.49
Rot. Bonds5

About 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide

6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide (PubChem CID 66673676) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide
PubChem CID66673676
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(Oc2ccc3c(c2)CCC3NC2CCCC2)nc1
InChIInChI=1S/C20H23N3O2/c21-20(24)14-6-10-19(22-12-14)25-16-7-8-17-13(11-16)5-9-18(17)23-15-3-1-2-4-15/h6-8,10-12,15,18,23H,1-5,9H2,(H2,21,24)
InChIKeyPOVPPLVXXOUPMX-UHFFFAOYSA-N
XLogP3.49
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide?
The IUPAC name of 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide (CID 66673676) is 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide?
The canonical SMILES for 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide is NC(=O)c1ccc(Oc2ccc3c(c2)CCC3NC2CCCC2)nc1.
What is the InChIKey of 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide?
The InChIKey is POVPPLVXXOUPMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c21-20(24)14-6-10-19(22-12-14)25-16-7-8-17-13(11-16)5-9-18(17)23-15-3-1-2-4-15/h6-8,10-12,15,18,23H,1-5,9H2,(H2,21,24).
What are the key properties of 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide?
6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-(cyclopentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide is sourced from PubChem (CID 66673676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).