5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine

C19H19ClN2 — CID 25214710

IUPAC5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine
SMILESClc1cc(NC2CCCC2)c2[nH]c(-c3ccccc3)cc2c1
InChIInChI=1S/C19H19ClN2/c20-15-10-14-11-17(13-6-2-1-3-7-13)22-19(14)18(12-15)21-16-8-4-5-9-16/h1-3,6-7,10-12,16,21-22H,4-5,8-9H2
InChIKeyVKQCQQGSHHJRBG-UHFFFAOYSA-N
MW310.83 g/mol
LogP5.84
Rot. Bonds3

About 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine

5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine (PubChem CID 25214710) has the molecular formula C19H19ClN2 and a molecular weight of 310.83 g/mol. Its IUPAC name is 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine.

Molecular Properties

Compound Name5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine
PubChem CID25214710
Molecular FormulaC19H19ClN2
Molecular Weight310.83 g/mol
Exact Mass310.12
IUPAC Name5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine
SMILESClc1cc(NC2CCCC2)c2[nH]c(-c3ccccc3)cc2c1
InChIInChI=1S/C19H19ClN2/c20-15-10-14-11-17(13-6-2-1-3-7-13)22-19(14)18(12-15)21-16-8-4-5-9-16/h1-3,6-7,10-12,16,21-22H,4-5,8-9H2
InChIKeyVKQCQQGSHHJRBG-UHFFFAOYSA-N
XLogP5.84
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.83
LogP ≤ 55.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine?
The IUPAC name of 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine (CID 25214710) is 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine.
What is the SMILES notation for 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine?
The canonical SMILES for 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine is Clc1cc(NC2CCCC2)c2[nH]c(-c3ccccc3)cc2c1.
What is the InChIKey of 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine?
The InChIKey is VKQCQQGSHHJRBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2/c20-15-10-14-11-17(13-6-2-1-3-7-13)22-19(14)18(12-15)21-16-8-4-5-9-16/h1-3,6-7,10-12,16,21-22H,4-5,8-9H2.
What are the key properties of 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine?
5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine has a molecular weight of 310.83 g/mol, XLogP of 5.84, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclopentyl-2-phenyl-1H-indol-7-amine is sourced from PubChem (CID 25214710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).