cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone

C19H23N3O2 — CID 110801628

IUPACcyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone
SMILESO=C(c1c[nH]c2ccccc12)N1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C19H23N3O2/c23-18(14-5-1-2-6-14)21-9-11-22(12-10-21)19(24)16-13-20-17-8-4-3-7-15(16)17/h3-4,7-8,13-14,20H,1-2,5-6,9-12H2
InChIKeyVESXVQGCNRPGFX-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.64
Rot. Bonds2

About cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone

cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone (PubChem CID 110801628) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone
PubChem CID110801628
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Namecyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone
SMILESO=C(c1c[nH]c2ccccc12)N1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C19H23N3O2/c23-18(14-5-1-2-6-14)21-9-11-22(12-10-21)19(24)16-13-20-17-8-4-3-7-15(16)17/h3-4,7-8,13-14,20H,1-2,5-6,9-12H2
InChIKeyVESXVQGCNRPGFX-UHFFFAOYSA-N
XLogP2.64
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone?
The IUPAC name of cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone (CID 110801628) is cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone?
The canonical SMILES for cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone is O=C(c1c[nH]c2ccccc12)N1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone?
The InChIKey is VESXVQGCNRPGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c23-18(14-5-1-2-6-14)21-9-11-22(12-10-21)19(24)16-13-20-17-8-4-3-7-15(16)17/h3-4,7-8,13-14,20H,1-2,5-6,9-12H2.
What are the key properties of cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone?
cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone has a molecular weight of 325.41 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[4-(1H-indole-3-carbonyl)piperazin-1-yl]methanone is sourced from PubChem (CID 110801628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).