3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile

C14H15N3 — CID 22139473

IUPAC3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile
SMILESN#Cc1ccc2[nH]cc(C3CCC(N)C3)c2c1
InChIInChI=1S/C14H15N3/c15-7-9-1-4-14-12(5-9)13(8-17-14)10-2-3-11(16)6-10/h1,4-5,8,10-11,17H,2-3,6,16H2
InChIKeyMBZJCLUPDBZVMZ-UHFFFAOYSA-N
MW225.30 g/mol
LogP2.63
Rot. Bonds1

About 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile

3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile (PubChem CID 22139473) has the molecular formula C14H15N3 and a molecular weight of 225.30 g/mol. Its IUPAC name is 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile.

Molecular Properties

Compound Name3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile
PubChem CID22139473
Molecular FormulaC14H15N3
Molecular Weight225.30 g/mol
Exact Mass225.13
IUPAC Name3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile
SMILESN#Cc1ccc2[nH]cc(C3CCC(N)C3)c2c1
InChIInChI=1S/C14H15N3/c15-7-9-1-4-14-12(5-9)13(8-17-14)10-2-3-11(16)6-10/h1,4-5,8,10-11,17H,2-3,6,16H2
InChIKeyMBZJCLUPDBZVMZ-UHFFFAOYSA-N
XLogP2.63
TPSA65.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile?
The IUPAC name of 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile (CID 22139473) is 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile.
What is the SMILES notation for 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile?
The canonical SMILES for 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile is N#Cc1ccc2[nH]cc(C3CCC(N)C3)c2c1.
What is the InChIKey of 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile?
The InChIKey is MBZJCLUPDBZVMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3/c15-7-9-1-4-14-12(5-9)13(8-17-14)10-2-3-11(16)6-10/h1,4-5,8,10-11,17H,2-3,6,16H2.
What are the key properties of 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile?
3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile has a molecular weight of 225.30 g/mol, XLogP of 2.63, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminocyclopentyl)-1H-indole-5-carbonitrile is sourced from PubChem (CID 22139473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).