5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide

C20H26N2O2 — CID 11034760

IUPAC5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide
SMILESCC/C=C\CC1C(C)CCC1NC(=O)c1cc2cc(O)ccc2[nH]1
InChIInChI=1S/C20H26N2O2/c1-3-4-5-6-16-13(2)7-9-18(16)22-20(24)19-12-14-11-15(23)8-10-17(14)21-19/h4-5,8,10-13,16,18,21,23H,3,6-7,9H2,1-2H3,(H,22,24)/b5-4-
InChIKeyMOCPXJIGTNLZLZ-PLNGDYQASA-N
MW326.44 g/mol
LogP4.37
Rot. Bonds5

About 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide

5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide (PubChem CID 11034760) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide
PubChem CID11034760
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide
SMILESCC/C=C\CC1C(C)CCC1NC(=O)c1cc2cc(O)ccc2[nH]1
InChIInChI=1S/C20H26N2O2/c1-3-4-5-6-16-13(2)7-9-18(16)22-20(24)19-12-14-11-15(23)8-10-17(14)21-19/h4-5,8,10-13,16,18,21,23H,3,6-7,9H2,1-2H3,(H,22,24)/b5-4-
InChIKeyMOCPXJIGTNLZLZ-PLNGDYQASA-N
XLogP4.37
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide?
The IUPAC name of 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide (CID 11034760) is 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide?
The canonical SMILES for 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide is CC/C=C\CC1C(C)CCC1NC(=O)c1cc2cc(O)ccc2[nH]1.
What is the InChIKey of 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide?
The InChIKey is MOCPXJIGTNLZLZ-PLNGDYQASA-N. The full InChI is InChI=1S/C20H26N2O2/c1-3-4-5-6-16-13(2)7-9-18(16)22-20(24)19-12-14-11-15(23)8-10-17(14)21-19/h4-5,8,10-13,16,18,21,23H,3,6-7,9H2,1-2H3,(H,22,24)/b5-4-.
What are the key properties of 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide?
5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 4.37, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[3-methyl-2-[(Z)-pent-2-enyl]cyclopentyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 11034760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).